data_1x59_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 1x59 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.244 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 119.812 -0.137 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 119.258 -0.401 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--O 1.23 0.067 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.235 0.306 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 . . . . . 0 C--O 1.234 0.285 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 . . . . . 0 N--CA 1.465 0.286 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 . . . . . 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.499 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.499 ' HZ3' ' CD ' ' A' ' 40' ' ' GLU . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 111.131 0.049 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.07 0 CA-C-O 119.552 -0.582 . . . . 0.0 111.729 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.7 m -142.62 97.53 3.13 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.578 -2.008 . . . . 0.0 105.578 160.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -159.45 160.82 35.2 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.395 1.078 . . . . 0.0 109.42 -170.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.96 166.97 40.39 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 127.205 2.335 . . . . 0.0 111.394 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 p -149.66 120.71 7.71 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 161.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.55 30.63 1.74 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.618 1.967 . . . . 0.0 114.175 -176.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.96 128.07 28.37 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 156.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.9 ttm -70.9 -46.29 62.82 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.11 97.47 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.215 0.462 . . . . 0.0 110.982 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -40.02 91.21 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.579 -0.701 . . . . 0.0 111.306 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.24 -52.2 65.31 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.67 88.97 2.09 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.601 1.572 . . . . 0.0 109.548 -175.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.47 168.93 23.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.075 2.516 . . . . 0.0 111.78 -172.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.72 149.73 46.64 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 122.768 0.427 . . . . 0.0 109.866 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.46 68.28 2.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 126.348 1.859 . . . . 0.0 111.33 -176.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.0 m -77.11 79.44 3.64 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.063 -1.023 . . . . 0.0 110.843 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 33.5 tttt 63.61 154.71 0.05 Allowed 'General case' 0 C--O 1.241 0.613 0 C-N-CA 130.798 3.639 . . . . 0.0 112.008 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.6 pm0 -62.4 164.19 7.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 110.903 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -144.16 -69.03 0.31 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.073 0.949 . . . . 0.0 109.962 -173.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 53.0 27.54 5.73 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -173.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.69 125.46 19.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 165.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.37 174.82 3.06 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.766 0.793 . . . . 0.0 110.924 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -136.98 167.11 22.14 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.728 1.211 . . . . 0.0 110.362 174.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.59 160.08 4.28 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.648 1.979 . . . . 0.0 110.489 165.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -73.72 88.97 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.786 2.324 . . . . 0.0 110.875 -170.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt 46.67 56.17 6.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.561 1.544 . . . . 0.0 110.957 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.7 p -55.94 -34.9 66.08 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 52.42 52.77 35.25 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-O 117.454 -1.748 . . . . 0.0 114.226 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.81 95.63 0.65 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.417 2.745 . . . . 0.0 110.504 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 t -85.27 -152.74 0.16 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 170.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.4 t -163.45 167.35 21.68 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.455 0 C-N-CA 124.917 1.246 . . . . 0.0 110.0 174.949 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.559 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t -150.9 94.26 2.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 t -60.75 114.99 3.32 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.65 -170.32 34.64 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 108.082 -2.007 . . . . 0.0 108.082 -168.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.1 t -45.99 110.87 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 110.418 -178.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.2 m -144.63 166.38 25.34 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 109.437 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.46 -23.8 0.57 Allowed Glycine 0 CA--C 1.522 0.516 0 CA-C-O 118.937 -0.924 . . . . 0.0 112.889 174.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -51.85 65.49 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.898 1.349 . . . . 0.0 108.914 174.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.78 -35.88 79.45 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.197 0.523 . . . . 0.0 111.279 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.96 -27.6 64.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.692 0.797 . . . . 0.0 111.046 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.93 -8.47 7.2 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 146.13 97.45 0.21 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.21 -29.13 47.49 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 CA-C-N 119.929 1.864 . . . . 0.0 111.194 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 46.66 -69.0 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 130.923 3.689 . . . . 0.0 116.884 172.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -70.82 74.42 0.6 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.344 1.458 . . . . 0.0 108.817 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 t -90.51 152.08 21.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -147.59 -176.23 5.17 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 126.585 1.954 . . . . 0.0 106.305 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -130.26 111.39 12.34 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.209 0.913 . . . . 0.0 109.768 171.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -135.73 -179.74 5.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.554 1.942 . . . . 0.0 108.079 165.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -143.88 -11.3 0.67 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 166.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.279 14.3 p 44.59 50.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.29 1.836 . . . . 0.0 113.166 169.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.57 128.08 7.11 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.778 -1.201 . . . . 0.0 108.863 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.6 pttt -68.54 5.57 1.02 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.2 t -150.37 145.18 18.24 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.69 -177.11 3.62 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.465 2.777 . . . . 0.0 110.282 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.7 tttt -121.7 10.95 10.42 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.513 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.2 m -19.9 95.2 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 129.103 2.961 . . . . 0.0 113.866 -174.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.65 72.45 0.07 OUTLIER Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 -171.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.27 134.51 33.9 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.331 2.021 . . . . 0.0 109.03 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 t -154.84 -50.76 0.09 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.9 m 68.35 18.64 9.09 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 163.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.864 0 N-CA-C 107.519 -2.232 . . . . 0.0 107.519 178.534 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.231 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -153.62 58.55 0.75 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.918 1.287 . . . . 0.0 107.759 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.2 m -74.75 76.55 2.08 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.364 1.066 . . . . 0.0 109.884 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.41 -171.0 44.16 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 123.985 0.802 . . . . 0.0 111.85 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p 35.68 58.06 0.89 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 128.24 2.616 . . . . 0.0 113.279 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.9 m -144.77 153.8 42.05 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.265 1.026 . . . . 0.0 109.106 171.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.35 72.4 0.01 OUTLIER Glycine 0 C--N 1.333 0.361 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 39.5 mtt -71.27 -31.18 67.19 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -168.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.8 -45.38 78.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.923 0.783 . . . . 0.0 109.238 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -48.59 74.23 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 125.161 1.384 . . . . 0.0 110.514 173.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.32 -60.63 3.48 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 179.32 -158.47 22.47 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 119.325 0.966 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 136.49 25.87 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.637 2.891 . . . . 0.0 111.355 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -105.29 -27.51 11.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.257 1.023 . . . . 0.0 110.98 168.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 49.21 67.98 0.79 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.9 1.68 . . . . 0.0 112.65 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -59.54 114.75 2.87 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 156.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 140.34 55.64 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 160.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 53.92 -168.1 0.07 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.347 1.059 . . . . 0.0 110.705 -169.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? 44.13 55.96 5.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 127.056 2.142 . . . . 0.0 112.011 173.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -64.67 118.93 9.62 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.7 m -62.12 153.49 6.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.4 96.28 4.98 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.996 0.903 . . . . 0.0 112.226 -175.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -73.83 138.41 44.42 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.503 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.7 m -145.16 134.09 11.1 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 175.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.32 154.92 56.3 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.602 1.535 . . . . 0.0 110.001 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.69 69.75 1.36 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.496 -0.753 . . . . 0.0 110.579 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.8 m -53.89 151.7 6.3 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.082 0.953 . . . . 0.0 110.14 175.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.67 167.71 14.38 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -73.16 21.08 0.34 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.938 3.759 . . . . 0.0 115.237 -168.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -48.38 129.89 16.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.83 1.652 . . . . 0.0 111.073 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.8 p -68.85 117.4 10.48 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.574 1.95 . . . . 0.0 110.94 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 N-CA-C 106.646 -2.581 . . . . 0.0 106.646 177.424 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.831 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 62.86 174.3 0.15 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.422 1.489 . . . . 0.0 114.554 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.5 m -160.67 159.45 30.32 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.882 1.673 . . . . 0.0 108.782 163.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.55 -175.79 30.23 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 124.957 1.265 . . . . 0.0 110.085 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m -123.66 -15.16 7.1 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.841 0.82 . . . . 0.0 112.262 174.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.0 t -149.67 148.78 29.69 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.48 102.0 0.2 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 -166.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -29.03 67.58 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.934 0.894 . . . . 0.0 112.845 -170.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.29 -27.1 66.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.507 0.723 . . . . 0.0 111.708 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -90.61 -32.95 16.05 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.617 -0.677 . . . . 0.0 110.551 177.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.44 -50.23 74.75 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.7 173.2 22.12 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -168.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.94 -170.9 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.441 3.427 . . . . 0.0 111.99 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.9 139.93 33.82 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 159.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 65.24 140.56 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.962 2.105 . . . . 0.0 111.381 -169.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 t 34.13 59.89 0.58 Allowed 'General case' 0 C--O 1.238 0.465 0 C-N-CA 126.865 2.066 . . . . 0.0 112.245 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -38.2 117.1 0.58 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.836 1.655 . . . . 0.0 110.369 173.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.71 146.32 21.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.635 1.174 . . . . 0.0 111.027 -175.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.98 -41.1 21.23 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 124.24 1.016 . . . . 0.0 109.213 163.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.05 113.9 26.29 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.409 0.55 . . . . 0.0 109.607 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.79 58.81 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 124.945 1.298 . . . . 0.0 110.792 -171.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mm? 57.62 -175.95 0.07 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.845 1.258 . . . . 0.0 109.86 -164.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -140.61 73.05 1.41 Allowed 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 170.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.5 p -128.19 87.82 54.41 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -167.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.7 148.26 52.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.823 2.348 . . . . 0.0 112.045 -173.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.0 tppt? -151.53 136.31 17.18 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -64.83 -42.61 94.8 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.311 0.96 . . . . 0.0 109.492 167.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 147.49 -164.23 28.74 Favored Glycine 0 CA--C 1.531 1.036 0 N-CA-C 108.601 -1.799 . . . . 0.0 108.601 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -67.42 170.64 13.14 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.347 2.031 . . . . 0.0 111.14 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 t -154.83 167.35 30.56 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.288 1.435 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.1 p -136.12 170.35 16.16 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.672 0.669 . . . . 0.0 111.426 -175.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 C-N-CA 127.345 2.403 . . . . 0.0 109.051 172.543 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -152.26 163.25 39.81 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 126.72 2.008 . . . . 0.0 106.897 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.0 m -67.74 -76.39 0.09 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 149.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 88.05 -172.24 41.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 -159.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -154.55 -26.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.576 0.75 . . . . 0.0 110.486 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 m -71.77 -75.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 158.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.51 69.71 1.18 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 176.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 ptt? -54.69 -29.8 54.0 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.274 1.029 . . . . 0.0 112.435 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.77 -36.33 37.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.274 1.03 . . . . 0.0 111.027 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -62.14 -35.76 79.76 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.29 -42.53 95.67 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.42 112.51 4.18 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 126.82 2.152 . . . . 0.0 111.247 -171.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.31 -4.4 14.22 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.167 2.578 . . . . 0.0 113.152 -176.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -126.87 95.06 4.21 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.7 1.2 . . . . 0.0 109.186 -174.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.09 75.08 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 108.943 -171.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.7 t -125.63 75.58 1.5 Allowed 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.99 -1.069 . . . . 0.0 109.544 -173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mtpt -71.51 77.13 0.79 Allowed 'General case' 0 C--O 1.238 0.483 0 C-N-CA 123.177 0.591 . . . . 0.0 110.174 168.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 64.48 -79.92 0.03 OUTLIER 'General case' 0 C--O 1.234 0.263 0 C-N-CA 128.63 2.772 . . . . 0.0 112.102 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -138.59 136.92 36.49 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.214 0.916 . . . . 0.0 110.342 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 129.88 15.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.633 2.773 . . . . 0.0 106.593 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -161.85 80.63 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -155.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 tt -133.51 -45.77 0.82 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 117.506 -1.235 . . . . 0.0 112.333 -163.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.7 mttm 49.69 82.37 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.064 1.746 . . . . 0.0 112.107 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.5 t -117.67 135.38 23.28 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 123.406 0.682 . . . . 0.0 111.606 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -80.03 167.26 20.18 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 124.432 3.421 . . . . 0.0 112.0 174.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -140.09 153.42 46.73 Favored 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 109.854 -175.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 m -144.48 170.03 16.82 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 151.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.89 -175.58 11.11 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.51 1.529 . . . . 0.0 113.059 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -80.56 35.09 0.56 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.368 3.379 . . . . 0.0 112.248 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.8 m 65.85 120.81 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.838 1.655 . . . . 0.0 109.689 -149.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 69.58 102.48 0.06 Allowed 'General case' 0 C--O 1.236 0.374 0 C-N-CA 126.278 1.831 . . . . 0.0 110.318 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 173.916 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -124.97 90.92 3.33 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.286 1.434 . . . . 0.0 108.185 -178.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 p -63.6 159.15 19.49 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.623 1.169 . . . . 0.0 110.808 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.22 39.94 95.18 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 123.651 0.643 . . . . 0.0 112.422 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 t -121.96 85.6 2.44 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.809 -1.922 . . . . 0.0 105.809 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.6 p 50.71 177.68 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.487 2.715 . . . . 0.0 113.439 -156.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.22 161.51 19.69 Favored Glycine 0 C--O 1.24 0.512 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.6 ttm -93.77 -28.45 15.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.35 1.06 . . . . 0.0 111.451 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.68 87.75 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 118.567 0.622 . . . . 0.0 109.584 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -57.35 -43.89 83.87 Favored 'General case' 0 C--O 1.23 0.067 0 C-N-CA 125.073 1.349 . . . . 0.0 110.063 172.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.48 -22.48 65.46 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -151.16 77.35 0.23 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.594 1.569 . . . . 0.0 110.022 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -78.24 49.56 3.06 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 124.652 3.568 . . . . 0.0 110.605 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 69.27 145.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 128.322 2.649 . . . . 0.0 111.843 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 42.46 92.02 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 129.374 3.07 . . . . 0.0 114.641 -168.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.76 12.71 29.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.547 -1.346 . . . . 0.0 113.056 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -151.99 130.11 11.91 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 120.656 -1.277 . . . . 0.0 109.364 176.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 45.04 -172.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 111.223 -152.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 mmtm 57.23 26.96 12.89 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.974 -1.079 . . . . 0.0 112.972 170.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -76.79 77.14 3.41 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.16 55.76 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.221 0 C-N-CA 126.066 1.746 . . . . 0.0 107.933 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -123.82 118.62 27.56 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.642 1.977 . . . . 0.0 106.425 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 35.42 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 128.947 2.899 . . . . 0.0 112.422 173.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.7 123.08 9.26 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 126.068 1.747 . . . . 0.0 110.61 -172.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.7 -41.26 32.05 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.08 1.853 . . . . 0.0 113.249 -172.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -156.14 -178.77 7.56 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.234 0.925 . . . . 0.0 109.649 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -144.88 165.41 28.21 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.631 1.572 . . . . 0.0 107.895 168.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 133.47 -170.43 22.32 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -168.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.37 157.7 60.17 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 121.734 1.623 . . . . 0.0 110.138 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -169.39 173.88 6.32 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.793 2.037 . . . . 0.0 108.008 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m 53.18 -150.79 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.52 0.728 . . . . 0.0 111.325 173.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.241 0 N-CA-C 106.524 -2.63 . . . . 0.0 106.524 -151.766 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.856 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -117.39 -31.9 5.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.023 0.929 . . . . 0.0 109.668 163.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.7 p -153.55 179.56 8.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.602 1.561 . . . . 0.0 108.7 167.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.73 -179.35 47.84 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 168.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.6 m 51.2 60.11 4.11 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.657 1.183 . . . . 0.0 112.693 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.0 m -59.01 102.57 0.13 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 164.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -163.91 150.84 19.77 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 126.012 1.768 . . . . 0.0 109.573 -168.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.37 -43.86 96.44 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.152 -0.927 . . . . 0.0 112.764 -163.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.2 -47.16 74.81 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.316 0.962 . . . . 0.0 110.092 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.65 -42.59 98.09 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.048 -0.408 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.81 -65.84 0.61 Allowed 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -58.61 105.48 0.67 Allowed Glycine 0 CA--C 1.525 0.707 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.68 -166.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -65.17 122.22 9.91 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.629 2.219 . . . . 0.0 108.2 -171.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -167.68 -62.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 118.4 -0.809 . . . . 0.0 111.057 -163.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 30.3 78.69 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.982 2.113 . . . . 0.0 112.672 -167.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 87.7 p -123.43 89.3 3.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 171.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -158.09 -176.25 5.81 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.85 0.86 . . . . 0.0 109.599 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -82.38 144.14 30.74 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.252 0.549 . . . . 0.0 110.344 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -67.75 103.52 1.44 Allowed 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.653 1.981 . . . . 0.0 108.137 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -155.52 82.92 1.04 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.712 0.768 . . . . 0.0 109.932 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.2 p -147.66 144.08 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.052 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 tp -143.72 58.57 1.37 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.232 1.013 . . . . 0.0 109.358 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.266 18.9 pttp 43.37 66.63 0.77 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.945 2.098 . . . . 0.0 113.161 -166.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.66 156.81 42.0 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 123.639 0.776 . . . . 0.0 112.139 175.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.43 156.47 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.022 2.481 . . . . 0.0 109.795 169.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -121.96 48.55 1.7 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.449 1.9 . . . . 0.0 108.308 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 61.0 p -47.29 118.03 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.087 1.755 . . . . 0.0 111.014 174.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -121.45 -178.99 15.96 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.039 0.828 . . . . 0.0 112.429 -163.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.18 160.0 40.46 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.502 2.134 . . . . 0.0 110.285 172.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.9 m 40.33 49.78 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.05 2.14 . . . . 0.0 111.377 171.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -100.62 85.32 2.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.309 1.444 . . . . 0.0 107.875 -165.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 -175.82 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -142.45 158.24 43.9 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.924 1.29 . . . . 0.0 108.529 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t 48.22 -159.19 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.833 1.653 . . . . 0.0 110.682 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.46 170.1 42.47 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 120.347 -1.47 . . . . 0.0 112.085 173.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.9 t -77.12 113.43 14.84 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.7 p -145.6 72.98 1.33 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.29 163.14 28.81 Favored Glycine 0 CA--C 1.524 0.639 0 C-N-CA 124.62 1.105 . . . . 0.0 112.026 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -57.54 -42.51 83.06 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.291 1.436 . . . . 0.0 110.513 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.5 -58.67 7.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.269 0.627 . . . . 0.0 110.488 -176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -65.14 -28.0 69.12 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.183 -0.323 . . . . 0.0 111.835 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.69 -15.2 51.38 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.93 81.12 0.55 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 -165.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.96 -28.17 6.32 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.428 2.085 . . . . 0.0 111.583 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -163.4 -63.18 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 126.208 1.803 . . . . 0.0 107.033 176.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 148.72 39.96 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.168 0.987 . . . . 0.0 109.065 169.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m -121.18 164.4 16.96 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.861 0.865 . . . . 0.0 109.061 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 39.3 68.46 0.36 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.691 1.596 . . . . 0.0 111.048 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -60.37 122.07 13.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 168.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -66.3 123.47 20.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.232 0.923 . . . . 0.0 108.538 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.66 162.23 35.6 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.739 0.816 . . . . 0.0 110.825 175.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -69.72 130.76 34.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 166.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 mp -71.54 143.51 49.9 Favored 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 pttm 39.08 68.54 0.35 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.258 1.823 . . . . 0.0 113.302 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.9 t -50.73 138.76 22.72 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 123.312 0.645 . . . . 0.0 111.174 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.03 -7.52 20.0 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.742 2.295 . . . . 0.0 113.432 -176.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -74.66 91.82 2.39 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.444 1.475 . . . . 0.0 107.57 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.3 m -137.45 110.46 7.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.813 2.045 . . . . 0.0 106.275 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -127.09 75.72 0.41 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 118.54 -1.145 . . . . 0.0 111.077 -175.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.77 -9.34 21.05 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.008 2.472 . . . . 0.0 114.987 -172.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 47.47 -98.57 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.962 1.705 . . . . 0.0 112.585 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -146.22 -39.61 0.22 Allowed 'General case' 0 C--N 1.332 -0.169 0 O-C-N 120.928 -1.107 . . . . 0.0 109.374 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 106.375 -2.69 . . . . 0.0 106.375 166.596 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -150.64 176.73 10.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.545 0.738 . . . . 0.0 109.26 161.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 t -128.73 -34.81 1.95 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 126.683 1.993 . . . . 0.0 110.435 -174.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.74 -89.76 0.16 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.034 -2.027 . . . . 0.0 108.034 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -165.36 -79.79 0.03 OUTLIER 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 99.13 76.36 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 129.641 3.177 . . . . 0.0 111.606 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -162.44 171.15 38.23 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ttt -89.46 -46.74 8.48 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 168.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.3 -48.22 81.19 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.46 -10.5 59.86 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.671 0.789 . . . . 0.0 111.93 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.09 -56.72 18.61 Favored 'General case' 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.58 170.55 11.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 124.49 1.043 . . . . 0.0 111.07 178.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 30.89 0.26 Allowed 'Trans proline' 0 CA--C 1.543 0.936 1 C-N-CA 126.359 4.706 . . . . 0.0 112.344 174.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -51.69 -63.36 1.16 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.889 2.076 . . . . 0.0 110.653 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -145.13 92.45 2.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.1 t -150.54 -31.84 0.18 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.702 0.801 . . . . 0.0 112.576 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 60.26 -5.84 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.895 2.478 . . . . 0.0 115.091 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -110.53 109.27 19.54 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 120.941 -1.099 . . . . 0.0 108.247 -158.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -163.04 77.74 0.44 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.497 1.119 . . . . 0.0 108.581 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -101.58 85.37 2.74 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.544 -0.723 . . . . 0.0 110.098 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.95 126.1 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.33 108.49 4.81 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -134.6 149.32 50.58 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.852 2.061 . . . . 0.0 107.439 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 t -57.09 143.47 72.17 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 166.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.97 67.89 5.83 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.655 2.904 . . . . 0.0 110.782 -175.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -147.76 132.3 17.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 126.816 2.047 . . . . 0.0 107.916 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 60.0 m -161.32 137.81 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.894 1.678 . . . . 0.0 107.707 170.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 127.31 -174.48 18.38 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 118.466 0.576 . . . . 0.0 113.962 171.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.21 170.11 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.245 3.297 . . . . 0.0 110.985 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 54.5 p -139.18 145.16 38.99 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 164.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.34 -35.32 0.25 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.711 2.004 . . . . 0.0 114.935 -175.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 107.815 -2.114 . . . . 0.0 107.815 -176.936 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 48.62 31.62 3.06 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.711 1.605 . . . . 0.0 114.044 165.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.32 128.69 36.27 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 144.23 -159.49 27.7 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -166.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -159.61 172.99 16.8 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.29 1.036 . . . . 0.0 109.513 169.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 m 55.48 64.23 1.83 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.909 1.284 . . . . 0.0 111.086 166.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.37 163.93 34.2 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.9 mtt -67.82 -50.6 55.88 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.77 90.09 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.26 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -56.73 -58.89 6.16 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.769 0.713 . . . . 0.0 109.892 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.84 -56.39 15.79 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -53.32 93.68 0.01 OUTLIER Glycine 0 C--N 1.34 0.79 0 C-N-CA 127.31 2.385 . . . . 0.0 110.903 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -77.03 -28.74 5.73 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 CA-C-N 118.61 1.205 . . . . 0.0 112.07 -146.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 t0 175.68 121.79 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 C-N-CA 129.112 2.965 . . . . 0.0 105.798 157.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -139.89 -64.89 0.47 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.417 0.553 . . . . 0.0 110.575 -168.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.252 88.6 p 44.72 -166.23 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.756 2.022 . . . . 0.0 113.4 -169.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -169.35 161.68 10.05 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.208 1.803 . . . . 0.0 109.084 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 59.18 -85.6 0.02 OUTLIER 'General case' 0 C--O 1.237 0.404 0 C-N-CA 127.524 2.33 . . . . 0.0 111.883 176.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -61.08 152.32 28.57 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.708 1.14 . . . . 0.0 108.207 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -114.37 136.67 52.73 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.867 1.667 . . . . 0.0 108.069 -168.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.259 34.0 m 42.73 44.88 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 127.159 2.183 . . . . 0.0 112.839 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -72.74 76.2 1.12 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.072 1.349 . . . . 0.0 109.376 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 ptpp? -65.52 142.58 58.07 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 126.79 2.036 . . . . 0.0 110.612 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.5 p -109.63 153.07 43.12 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 123.977 0.911 . . . . 0.0 111.268 -158.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -76.22 116.29 4.32 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 113.42 -173.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -73.68 48.5 0.28 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.312 2.245 . . . . 0.0 113.422 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -43.94 97.55 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.777 -1.202 . . . . 0.0 110.959 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.17 96.66 1.6 Allowed Glycine 0 CA--C 1.528 0.847 0 CA-C-O 117.689 -1.617 . . . . 0.0 110.876 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.04 125.03 13.45 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 CA-C-N 120.926 2.363 . . . . 0.0 108.217 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.9 t -160.56 142.9 12.85 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.3 1.44 . . . . 0.0 108.24 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.32 -98.17 0.03 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 N-CA-C 109.294 -1.523 . . . . 0.0 109.294 171.666 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.855 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -31.55 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.561 0.744 . . . . 0.0 111.247 170.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -149.43 -177.94 6.14 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.093 1.357 . . . . 0.0 108.633 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.18 13.01 0.03 OUTLIER Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.392 1.949 . . . . 0.0 112.473 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 p -160.48 147.54 15.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 119.962 1.881 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.0 m -145.48 62.21 1.28 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.881 0.872 . . . . 0.0 111.211 169.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.69 172.98 40.21 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 120.777 -1.202 . . . . 0.0 111.598 172.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.0 tmm? -66.72 -51.57 54.42 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 117.366 0.583 . . . . 0.0 109.981 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.22 -46.37 89.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.258 0.623 . . . . 0.0 111.193 -176.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.0 -53.29 58.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 123.154 0.582 . . . . 0.0 109.746 173.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.28 -47.77 82.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -98.53 -170.45 31.67 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.095 1.331 . . . . 0.0 111.194 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.4 -69.07 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.327 2.685 . . . . 0.0 112.34 -167.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -163.26 145.69 10.09 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.08 10.44 3.56 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.346 0.976 . . . . 0.0 112.469 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -56.25 102.87 0.09 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.373 1.069 . . . . 0.0 111.956 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -165.67 94.52 0.6 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -101.6 -9.33 21.06 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -174.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -149.9 -174.92 4.85 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.267 1.427 . . . . 0.0 107.196 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -66.71 112.96 4.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 173.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.1 m -137.26 98.42 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 104.917 -2.253 . . . . 0.0 104.917 170.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 52.6 tp -80.25 82.89 6.21 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.488 1.515 . . . . 0.0 107.607 -173.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -146.94 -178.68 6.32 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.701 1.201 . . . . 0.0 110.109 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.1 t -134.75 157.3 77.5 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 126.415 1.886 . . . . 0.0 107.11 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -73.26 125.49 10.29 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.591 2.194 . . . . 0.0 110.839 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.43 140.18 35.38 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.484 1.114 . . . . 0.0 108.227 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.3 m 59.25 170.9 0.07 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.233 1.813 . . . . 0.0 112.578 -173.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 170.54 176.33 39.87 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -71.68 179.05 5.04 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.71 2.273 . . . . 0.0 109.895 164.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -155.24 -74.57 0.11 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.438 -0.789 . . . . 0.0 109.586 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -171.4 2.5 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 128.809 2.844 . . . . 0.0 106.358 175.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 159.018 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -79.71 96.22 6.18 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 166.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.2 m -59.34 100.26 0.07 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.885 1.274 . . . . 0.0 109.134 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.8 62.89 0.64 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -167.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.7 t -121.78 173.97 7.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.771 1.228 . . . . 0.0 107.777 174.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.9 m -137.12 42.93 2.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.826 1.25 . . . . 0.0 108.934 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.71 130.06 21.83 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 124.385 0.993 . . . . 0.0 110.647 176.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 ttp -66.48 -49.45 66.58 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -174.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.02 -28.64 62.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.968 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.01 -51.64 66.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.702 0.683 . . . . 0.0 109.272 173.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.13 -33.51 67.45 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.41 104.99 2.77 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.59 1.567 . . . . 0.0 109.399 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -72.29 169.31 21.91 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.68 2.253 . . . . 0.0 110.873 -177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -49.5 139.52 12.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.856 1.262 . . . . 0.0 108.758 159.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -56.05 140.85 42.21 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 167.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.72 2.44 4.16 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.668 -0.645 . . . . 0.0 112.357 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -64.37 136.28 56.97 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.733 1.213 . . . . 0.0 109.299 170.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -67.54 99.02 0.72 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 172.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -142.46 74.93 1.47 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -172.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 49.59 56.43 7.86 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.813 1.645 . . . . 0.0 112.393 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -139.77 79.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 121.123 -0.986 . . . . 0.0 110.151 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mp 53.57 -145.96 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.949 1.3 . . . . 0.0 108.485 -172.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -134.26 64.04 1.61 Allowed 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.78 1.232 . . . . 0.0 109.403 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.3 m 62.95 147.42 0.09 OUTLIER Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 127.034 2.134 . . . . 0.0 111.536 -168.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.81 -61.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.887 2.391 . . . . 0.0 110.74 169.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.69 164.03 37.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 128.07 2.548 . . . . 0.0 108.059 176.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 7.6 t -81.12 164.46 22.38 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.107 0.48 . . . . 0.0 109.826 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.57 168.55 12.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.516 2.007 . . . . 0.0 110.635 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.67 177.3 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.868 2.378 . . . . 0.0 109.81 170.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.4 m -121.88 143.84 49.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 153.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 m 56.83 175.01 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.307 1.043 . . . . 0.0 111.979 -164.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 -163.497 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.534 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.88 85.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.884 1.673 . . . . 0.0 110.03 -168.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t 69.91 171.13 0.31 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.323 1.849 . . . . 0.0 111.695 -173.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 62.1 173.94 1.79 Allowed Glycine 0 CA--C 1.531 1.031 0 C-N-CA 127.187 2.327 . . . . 0.0 115.515 173.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.76 142.91 15.53 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.86 1.264 . . . . 0.0 108.308 174.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 t -150.02 140.57 22.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.038 1.335 . . . . 0.0 108.059 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.76 -177.32 35.62 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.962 173.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -67.67 -71.37 0.21 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.009 0.923 . . . . 0.0 108.973 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.8 -48.74 69.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.063 0.945 . . . . 0.0 112.968 -169.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -68.76 -27.55 65.99 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.557 -0.714 . . . . 0.0 111.181 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.02 -6.62 4.12 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -90.78 103.41 3.04 Favored Glycine 0 CA--C 1.53 1.029 0 N-CA-C 107.392 -2.283 . . . . 0.0 107.392 158.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.7 55.14 2.64 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 124.086 3.191 . . . . 0.0 110.35 169.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -77.19 169.46 18.29 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.761 1.224 . . . . 0.0 109.142 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.42 115.62 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.1 m -68.18 168.12 12.85 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.921 0.867 . . . . 0.0 110.424 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -52.4 138.08 27.94 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 155.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.2 tm0? -114.29 -31.66 6.21 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 -171.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -146.83 162.44 38.61 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -61.55 104.72 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 119.054 0.843 . . . . 0.0 108.92 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 68.3 t -139.69 65.43 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.3 tp -91.54 168.91 11.18 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -131.12 148.47 52.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 68.05 152.6 0.13 Allowed Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 124.685 1.241 . . . . 0.0 109.91 -165.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -82.28 163.01 17.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 0.0 110.958 175.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -133.99 164.69 26.74 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.39 -0.818 . . . . 0.0 108.872 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.9 t -74.39 99.44 3.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.26 85.18 0.38 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.168 2.318 . . . . 0.0 110.289 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.63 92.76 0.94 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.282 2.654 . . . . 0.0 109.872 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -152.91 118.22 5.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -135.45 -39.73 0.73 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.426 1.49 . . . . 0.0 112.315 -172.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.426 0 C-N-CA 126.696 2.094 . . . . 0.0 108.261 -173.138 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.744 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -69.29 155.31 40.63 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.079 0.951 . . . . 0.0 112.577 -173.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.0 p -143.91 45.08 1.47 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.748 2.019 . . . . 0.0 109.165 -172.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 119.48 170.43 14.52 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -162.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 m -87.61 136.02 33.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 164.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -151.2 90.99 1.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 172.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.81 99.27 0.22 Allowed Glycine 0 CA--C 1.508 -0.37 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -173.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -54.52 -40.26 68.43 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.214 1.006 . . . . 0.0 112.158 -176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.04 -52.82 63.33 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.433 0.561 . . . . 0.0 110.471 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.24 -43.08 99.63 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -60.1 -75.66 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.06 74.39 1.28 Allowed Glycine 0 CA--C 1.53 1.022 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -164.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.51 -46.53 3.82 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.229 1.953 . . . . 0.0 111.255 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -170.31 94.51 0.23 Allowed 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 126.502 1.921 . . . . 0.0 107.293 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.98 136.62 10.16 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.8 m -73.84 104.69 4.81 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -136.04 -63.19 0.66 Allowed 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 124.261 1.024 . . . . 0.0 110.228 -176.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 65.11 -66.77 0.13 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.276 1.83 . . . . 0.0 112.123 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.0 mttm 59.0 17.88 5.8 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.723 2.009 . . . . 0.0 112.358 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -117.38 67.78 0.74 Allowed 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.408 1.483 . . . . 0.0 107.86 -167.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.6 88.36 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -58.29 157.46 8.48 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 168.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -129.71 -6.59 4.59 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.3 t -159.23 148.57 14.57 Favored Pre-proline 0 C--O 1.243 0.717 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.31 94.02 0.91 Allowed 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.333 2.688 . . . . 0.0 108.0 176.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 136.54 57.16 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.44 149.62 22.6 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 167.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.88 177.49 46.71 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.25 95.02 0.49 Allowed 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.376 2.717 . . . . 0.0 110.481 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.4 t -66.01 -176.22 0.38 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.734 0.778 . . . . 0.0 109.078 164.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 p -125.96 130.12 50.62 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.041 1.337 . . . . 0.0 107.886 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.764 0 C-N-CA 124.554 1.073 . . . . 0.0 110.894 -177.084 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.71 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -75.33 173.99 10.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.9 1.68 . . . . 0.0 110.452 170.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.2 p -106.7 -8.2 16.97 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.747 -1.22 . . . . 0.0 112.03 166.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.96 -96.68 0.97 Allowed Glycine 0 C--N 1.337 0.591 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 m -158.51 166.77 31.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 126.595 1.958 . . . . 0.0 107.729 160.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.8 m -138.66 155.66 48.09 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.789 1.236 . . . . 0.0 107.691 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 173.75 61.24 0.05 OUTLIER Glycine 0 C--O 1.225 -0.413 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 177.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.06 -23.91 65.92 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.415 0.607 . . . . 0.0 112.609 -171.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.87 66.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.764 0.711 . . . . 0.0 110.737 171.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -47.87 77.49 Favored 'General case' 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.9 -15.73 63.21 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -105.62 -165.79 23.5 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.79 1.662 . . . . 0.0 111.328 -170.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -69.08 131.48 22.3 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.354 2.036 . . . . 0.0 107.101 169.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.58 133.71 54.22 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 122.79 0.436 . . . . 0.0 109.895 -169.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -92.23 163.39 13.93 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.206 1.002 . . . . 0.0 110.561 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.72 144.91 46.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.105 0.562 . . . . 0.0 109.527 175.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -150.51 -50.44 0.13 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.347 1.459 . . . . 0.0 110.361 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -159.81 130.89 5.87 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.351 0.661 . . . . 0.0 109.787 -171.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.93 94.44 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 128.477 2.711 . . . . 0.0 112.623 176.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -52.52 148.83 6.45 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 -175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 3.2 m -123.54 93.2 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 124.635 1.174 . . . . 0.0 108.036 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -140.62 104.72 4.79 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.173 1.389 . . . . 0.0 109.917 -175.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.6 mttt 52.12 -155.08 0.17 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.131 1.772 . . . . 0.0 109.563 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.6 p -117.65 150.34 46.66 Favored Pre-proline 0 C--O 1.24 0.58 0 CA-C-N 119.454 1.025 . . . . 0.0 111.981 -166.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.02 -51.36 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 123.026 2.484 . . . . 0.0 109.989 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? 40.69 54.06 3.09 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 126.235 1.814 . . . . 0.0 109.487 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.6 p -144.27 119.32 10.04 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.368 0.667 . . . . 0.0 110.251 -167.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 102.74 -154.65 18.33 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.35 151.92 64.56 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 121.87 1.714 . . . . 0.0 111.633 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 27.4 m -137.55 131.1 31.22 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.834 1.654 . . . . 0.0 107.771 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.3 p -87.37 175.04 8.18 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.592 0.757 . . . . 0.0 110.389 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.98 0 N-CA-C 105.698 -2.961 . . . . 0.0 105.698 179.497 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.0 m -153.05 -39.67 0.1 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.3 m -139.46 -28.25 0.77 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 119.025 0.83 . . . . 0.0 112.661 -174.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.79 146.76 38.95 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 173.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -79.98 65.51 5.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.063 . . . . 0.0 110.237 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.7 t -62.12 123.66 18.73 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 169.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 168.82 -95.3 0.11 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 108.676 -1.77 . . . . 0.0 108.676 -172.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.6 mtm -59.23 -45.69 90.46 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.182 0.991 . . . . 0.0 110.284 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.57 -7.8 3.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -90.55 -51.47 5.38 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 120.611 -1.305 . . . . 0.0 108.892 169.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -68.96 -10.52 57.82 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.35 -133.57 2.99 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -170.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -73.51 82.32 1.68 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.228 2.619 . . . . 0.0 109.278 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.71 146.73 48.33 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.748 1.219 . . . . 0.0 109.772 174.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -134.5 80.26 1.84 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 126.36 1.864 . . . . 0.0 106.83 178.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.3 m -74.13 67.34 1.32 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.345 1.458 . . . . 0.0 111.077 -176.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.59 -22.32 66.13 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.884 -1.135 . . . . 0.0 113.454 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -163.76 158.27 19.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 119.357 0.98 . . . . 0.0 108.802 169.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.19 -178.99 0.22 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.929 2.092 . . . . 0.0 112.477 176.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -124.48 -2.09 8.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.27 2.228 . . . . 0.0 111.807 -174.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.9 t 44.63 68.62 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 125.964 1.705 . . . . 0.0 111.404 174.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -120.34 172.76 7.58 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.269 1.428 . . . . 0.0 111.878 -174.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.09 -167.9 1.75 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.197 1.399 . . . . 0.0 109.642 -175.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.3 m -141.5 135.31 14.75 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 125.995 1.718 . . . . 0.0 106.715 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.76 130.6 15.98 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 122.737 2.292 . . . . 0.0 107.908 170.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 tttm -152.11 106.46 3.18 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 121.504 -0.747 . . . . 0.0 109.506 -173.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.96 74.07 0.12 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.846 2.459 . . . . 0.0 111.569 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -82.32 109.56 3.08 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.038 -1.423 . . . . 0.0 110.29 174.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.55 112.03 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.56 2.173 . . . . 0.0 108.365 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.2 t -75.34 99.07 4.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 171.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.4 m -76.46 -40.78 49.48 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.412 -0.805 . . . . 0.0 111.506 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.983 0 N-CA-C 107.377 -2.289 . . . . 0.0 107.377 169.534 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.621 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -56.54 162.89 1.99 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 m -64.35 160.62 18.54 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.87 0.468 . . . . 0.0 111.472 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.9 179.92 40.29 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.312 1.911 . . . . 0.0 108.592 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -137.25 167.41 21.63 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.509 1.523 . . . . 0.0 108.335 172.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.1 t -145.26 65.25 1.25 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.436 0.562 . . . . 0.0 110.426 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -155.67 166.41 32.83 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -66.8 -52.82 39.4 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 117.805 0.803 . . . . 0.0 111.009 -174.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.13 -33.31 73.18 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -68.48 -48.59 64.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.751 1.22 . . . . 0.0 109.691 175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.89 -55.83 30.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.22 0.18 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 108.839 -1.705 . . . . 0.0 108.839 -166.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -59.97 3.72 0.21 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.91 3.74 . . . . 0.0 115.151 173.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -161.46 -176.29 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.0 2.12 . . . . 0.0 107.835 -167.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -150.56 177.61 9.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 127.912 2.485 . . . . 0.0 107.838 -160.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m 28.58 55.48 0.1 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.612 2.365 . . . . 0.0 116.087 172.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -89.13 147.9 23.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 163.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -70.08 168.36 15.7 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.642 0.777 . . . . 0.0 109.374 160.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.98 166.49 11.35 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 122.264 1.03 . . . . 0.0 111.83 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -154.22 175.83 13.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.969 1.708 . . . . 0.0 107.484 173.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m -83.65 136.53 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 158.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.22 163.14 40.59 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -133.32 160.83 36.17 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 t -158.73 149.38 15.91 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.826 1.25 . . . . 0.0 107.772 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -76.82 152.97 33.0 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.867 1.711 . . . . 0.0 110.903 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.92 176.34 9.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.653 1.981 . . . . 0.0 108.248 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 69.9 m 60.48 -153.93 0.37 Allowed 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.881 1.272 . . . . 0.0 110.14 -173.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.04 174.36 46.71 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 107.877 -2.089 . . . . 0.0 107.877 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -67.37 104.33 0.89 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.194 2.596 . . . . 0.0 108.974 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 75.2 m 56.46 -171.41 0.08 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.145 0.978 . . . . 0.0 111.681 -172.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.9 t -152.64 132.46 13.25 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 N-CA-C 106.314 -2.714 . . . . 0.0 106.314 -164.161 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 p -63.38 163.69 10.31 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.104 0.961 . . . . 0.0 111.838 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.8 t -139.06 160.14 40.49 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 166.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.75 -173.26 22.41 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.567 1.079 . . . . 0.0 111.84 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -141.74 128.78 20.79 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.97 26.81 0.06 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.108 1.763 . . . . 0.0 113.392 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.69 129.76 9.15 Favored Glycine 0 C--N 1.333 0.364 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.64 -38.76 88.87 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.317 1.059 . . . . 0.0 109.771 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.83 94.32 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.389 1.875 . . . . 0.0 112.02 171.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -63.54 -42.4 98.41 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 121.301 -0.874 . . . . 0.0 110.624 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.78 -35.86 81.23 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.61 103.48 2.32 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.663 1.601 . . . . 0.0 109.542 -169.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -70.66 155.46 62.94 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.236 1.958 . . . . 0.0 110.43 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 53.89 59.23 4.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.658 1.583 . . . . 0.0 110.925 168.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.92 117.63 11.74 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -79.09 85.6 4.98 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -139.62 156.92 46.57 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -70.5 154.91 41.38 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -76.72 98.04 4.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.593 0.757 . . . . 0.0 111.253 -175.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -76.47 -10.37 59.35 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.821 -1.174 . . . . 0.0 111.62 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.7 t 51.2 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.23 1.812 . . . . 0.0 110.988 168.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 tt -144.68 94.64 2.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.078 -1.014 . . . . 0.0 108.855 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.36 114.83 4.54 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 162.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.2 m -61.58 153.47 70.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 165.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.65 -166.96 0.12 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.78 2.987 . . . . 0.0 112.12 165.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -131.53 -27.44 1.94 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.947 1.699 . . . . 0.0 110.688 164.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.8 m -147.69 167.11 25.47 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 119.457 1.026 . . . . 0.0 109.663 171.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.39 -175.81 43.33 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.157 1.361 . . . . 0.0 110.792 167.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.63 -71.02 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.221 3.28 . . . . 0.0 111.061 174.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.2 t -147.16 116.48 6.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 104.791 -2.299 . . . . 0.0 104.791 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.5 m -81.29 36.55 0.42 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.784 1.234 . . . . 0.0 112.009 -175.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.382 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.462 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.428 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -63.54 174.51 1.3 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.41 1.484 . . . . 0.0 113.056 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.6 t -126.75 -68.74 0.79 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.39 1.876 . . . . 0.0 106.934 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.64 -102.01 0.62 Allowed Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 165.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.9 m 36.78 59.8 1.0 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.842 2.057 . . . . 0.0 112.424 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.5 t -71.69 165.22 24.45 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 122.27 1.033 . . . . 0.0 110.992 -176.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.75 156.83 12.5 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 127.502 2.477 . . . . 0.0 107.42 173.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.4 ttt -68.57 -41.46 79.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 118.237 1.019 . . . . 0.0 110.386 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.12 96.2 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 123.529 0.732 . . . . 0.0 110.288 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.85 -48.3 80.19 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.543 1.137 . . . . 0.0 109.841 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.499 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.499 ' HZ3' ' CD ' ' A' ' 40' ' ' GLU . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.99 -60.11 3.7 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.49 141.17 3.98 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.16 -35.64 14.0 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 121.658 1.572 . . . . 0.0 111.295 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -98.6 70.95 1.96 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-O 122.108 0.956 . . . . 0.0 110.091 -162.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -155.66 46.7 0.49 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.318 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.37 -16.92 4.8 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -154.99 161.2 41.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.048 1.295 . . . . 0.0 109.497 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -136.87 160.94 37.39 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.045 0.938 . . . . 0.0 108.777 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -90.58 -26.91 19.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.874 0.87 . . . . 0.0 111.244 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -69.54 125.5 26.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 162.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 70.2 t -131.8 93.52 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.35 142.72 58.13 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -85.39 -69.82 0.63 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 165.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 p -57.47 156.33 16.69 Favored Pre-proline 0 CA--C 1.54 0.572 0 C-N-CA 124.276 1.031 . . . . 0.0 111.551 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.91 176.41 9.5 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.242 1.961 . . . . 0.0 109.743 -174.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -157.94 161.31 38.18 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.082 -1.011 . . . . 0.0 109.197 174.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 70.27 -0.81 2.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.082 2.153 . . . . 0.0 114.783 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -117.93 60.83 0.46 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-O 117.938 -1.479 . . . . 0.0 111.797 165.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -60.04 -47.53 14.94 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.807 3.005 . . . . 0.0 113.267 -172.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -162.76 135.86 5.81 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.604 1.961 . . . . 0.0 106.193 166.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -173.9 112.81 0.19 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 105.0 -2.222 . . . . 0.0 105.0 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 N-CA-C 104.165 -3.574 . . . . 0.0 104.165 176.241 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.799 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 t -138.32 156.81 47.28 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.202 1.001 . . . . 0.0 110.73 170.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.9 t -155.62 -13.2 0.11 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.006 2.122 . . . . 0.0 110.917 159.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.97 -77.7 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 CA-C-N 119.084 0.856 . . . . 0.0 111.814 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 m -61.52 143.86 55.24 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.68 . . . . 0.0 110.226 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 p -113.65 95.24 5.24 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.39 116.46 4.72 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 173.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -57.73 -28.25 63.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.773 1.287 . . . . 0.0 112.553 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -56.81 16.74 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.77 -30.85 71.56 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.983 0.913 . . . . 0.0 111.131 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.84 -10.16 26.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.64 97.98 1.77 Allowed Glycine 0 CA--C 1.53 1.017 0 CA-C-N 120.277 1.399 . . . . 0.0 110.729 177.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -68.18 137.45 40.51 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.227 1.951 . . . . 0.0 109.757 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -65.79 156.2 33.88 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.876 0.471 . . . . 0.0 110.535 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -135.18 87.06 2.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.589 0.756 . . . . 0.0 109.182 -156.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.5 p -138.14 -83.98 0.3 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 124.038 0.935 . . . . 0.0 109.016 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -64.86 118.92 9.73 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 35.44 66.96 0.3 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 126.808 2.043 . . . . 0.0 111.964 -174.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -82.7 158.75 22.79 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.332 159.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -156.54 100.51 1.95 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 m -140.68 139.24 35.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.193 0.597 . . . . 0.0 110.65 -164.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.5 tp -122.17 -93.54 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 117.23 -1.366 . . . . 0.0 108.884 170.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -139.08 80.75 1.8 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 126.267 1.827 . . . . 0.0 108.128 -171.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.1 p -141.64 97.81 6.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.408 -168.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.97 -31.5 55.88 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.266 1.311 . . . . 0.0 111.239 168.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 tttt 42.77 47.13 4.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.604 1.961 . . . . 0.0 111.265 -172.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -143.88 158.08 43.93 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.397 1.879 . . . . 0.0 108.593 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -157.04 103.61 0.24 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.24 -56.61 0.07 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.152 1.901 . . . . 0.0 110.145 -174.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -156.15 -70.98 0.11 Allowed 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 m 66.46 15.08 10.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.861 1.264 . . . . 0.0 113.061 -176.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 105.912 -2.875 . . . . 0.0 105.912 162.938 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.244 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 119.812 -0.137 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 119.258 -0.401 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--O 1.23 0.067 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HB3' HD21 ' A' ' 52' ' ' LEU . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.456 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 14' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.235 0.306 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 . . . . . 0 C--O 1.234 0.285 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 21' ' ' GLN . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.558 HD11 ' HE3' ' A' ' 49' ' ' LYS . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.558 ' HE3' HD11 ' A' ' 45' ' ' LEU . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 . . . . . 0 N--CA 1.465 0.286 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.499 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.406 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' HE3' ' A' ' 49' ' ' LYS . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HE3' HD11 ' A' ' 45' ' ' LEU . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 . . . . . 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB3' HD21 ' A' ' 52' ' ' LEU . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 14' ' ' LEU . 3.5 mm? . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.573 ' HA ' HD12 ' A' ' 28' ' ' LEU . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 25' ' ' VAL . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 111.131 0.049 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.07 0 CA-C-O 119.552 -0.582 . . . . 0.0 111.729 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.7 m -142.62 97.53 3.13 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.578 -2.008 . . . . 0.0 105.578 160.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -159.45 160.82 35.2 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.395 1.078 . . . . 0.0 109.42 -170.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.96 166.97 40.39 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 127.205 2.335 . . . . 0.0 111.394 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 p -149.66 120.71 7.71 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 161.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.55 30.63 1.74 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.618 1.967 . . . . 0.0 114.175 -176.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.96 128.07 28.37 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 156.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.9 ttm -70.9 -46.29 62.82 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.11 97.47 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.215 0.462 . . . . 0.0 110.982 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -40.02 91.21 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.579 -0.701 . . . . 0.0 111.306 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.24 -52.2 65.31 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.67 88.97 2.09 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.601 1.572 . . . . 0.0 109.548 -175.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.47 168.93 23.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.075 2.516 . . . . 0.0 111.78 -172.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.72 149.73 46.64 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 122.768 0.427 . . . . 0.0 109.866 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.46 68.28 2.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 126.348 1.859 . . . . 0.0 111.33 -176.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.0 m -77.11 79.44 3.64 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.063 -1.023 . . . . 0.0 110.843 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 33.5 tttt 63.61 154.71 0.05 Allowed 'General case' 0 C--O 1.241 0.613 0 C-N-CA 130.798 3.639 . . . . 0.0 112.008 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.6 pm0 -62.4 164.19 7.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 110.903 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -144.16 -69.03 0.31 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.073 0.949 . . . . 0.0 109.962 -173.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 53.0 27.54 5.73 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -173.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.69 125.46 19.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 165.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.37 174.82 3.06 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.766 0.793 . . . . 0.0 110.924 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -136.98 167.11 22.14 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.728 1.211 . . . . 0.0 110.362 174.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.59 160.08 4.28 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.648 1.979 . . . . 0.0 110.489 165.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -73.72 88.97 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.786 2.324 . . . . 0.0 110.875 -170.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt 46.67 56.17 6.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.561 1.544 . . . . 0.0 110.957 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.7 p -55.94 -34.9 66.08 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 52.42 52.77 35.25 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-O 117.454 -1.748 . . . . 0.0 114.226 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.81 95.63 0.65 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.417 2.745 . . . . 0.0 110.504 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 t -85.27 -152.74 0.16 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 170.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.4 t -163.45 167.35 21.68 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.455 0 C-N-CA 124.917 1.246 . . . . 0.0 110.0 174.949 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.559 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t -150.9 94.26 2.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 t -60.75 114.99 3.32 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.65 -170.32 34.64 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 108.082 -2.007 . . . . 0.0 108.082 -168.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.1 t -45.99 110.87 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 110.418 -178.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.2 m -144.63 166.38 25.34 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 109.437 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.46 -23.8 0.57 Allowed Glycine 0 CA--C 1.522 0.516 0 CA-C-O 118.937 -0.924 . . . . 0.0 112.889 174.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -51.85 65.49 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.898 1.349 . . . . 0.0 108.914 174.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.78 -35.88 79.45 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.197 0.523 . . . . 0.0 111.279 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.96 -27.6 64.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.692 0.797 . . . . 0.0 111.046 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.93 -8.47 7.2 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 146.13 97.45 0.21 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.21 -29.13 47.49 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 CA-C-N 119.929 1.864 . . . . 0.0 111.194 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 46.66 -69.0 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 130.923 3.689 . . . . 0.0 116.884 172.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -70.82 74.42 0.6 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.344 1.458 . . . . 0.0 108.817 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 t -90.51 152.08 21.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -147.59 -176.23 5.17 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 126.585 1.954 . . . . 0.0 106.305 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -130.26 111.39 12.34 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.209 0.913 . . . . 0.0 109.768 171.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -135.73 -179.74 5.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.554 1.942 . . . . 0.0 108.079 165.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -143.88 -11.3 0.67 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 166.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.279 14.3 p 44.59 50.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.29 1.836 . . . . 0.0 113.166 169.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.57 128.08 7.11 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.778 -1.201 . . . . 0.0 108.863 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.6 pttt -68.54 5.57 1.02 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.2 t -150.37 145.18 18.24 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.69 -177.11 3.62 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.465 2.777 . . . . 0.0 110.282 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.7 tttt -121.7 10.95 10.42 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.513 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.2 m -19.9 95.2 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 129.103 2.961 . . . . 0.0 113.866 -174.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.65 72.45 0.07 OUTLIER Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 -171.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.27 134.51 33.9 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.331 2.021 . . . . 0.0 109.03 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 t -154.84 -50.76 0.09 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.9 m 68.35 18.64 9.09 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 163.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.864 0 N-CA-C 107.519 -2.232 . . . . 0.0 107.519 178.534 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.231 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -153.62 58.55 0.75 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.918 1.287 . . . . 0.0 107.759 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.2 m -74.75 76.55 2.08 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.364 1.066 . . . . 0.0 109.884 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.41 -171.0 44.16 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 123.985 0.802 . . . . 0.0 111.85 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p 35.68 58.06 0.89 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 128.24 2.616 . . . . 0.0 113.279 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.9 m -144.77 153.8 42.05 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.265 1.026 . . . . 0.0 109.106 171.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.35 72.4 0.01 OUTLIER Glycine 0 C--N 1.333 0.361 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 39.5 mtt -71.27 -31.18 67.19 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -168.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.8 -45.38 78.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.923 0.783 . . . . 0.0 109.238 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -48.59 74.23 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 125.161 1.384 . . . . 0.0 110.514 173.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.32 -60.63 3.48 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 179.32 -158.47 22.47 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 119.325 0.966 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 136.49 25.87 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.637 2.891 . . . . 0.0 111.355 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -105.29 -27.51 11.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.257 1.023 . . . . 0.0 110.98 168.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 49.21 67.98 0.79 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.9 1.68 . . . . 0.0 112.65 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -59.54 114.75 2.87 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 156.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 140.34 55.64 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 160.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 53.92 -168.1 0.07 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.347 1.059 . . . . 0.0 110.705 -169.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? 44.13 55.96 5.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 127.056 2.142 . . . . 0.0 112.011 173.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -64.67 118.93 9.62 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.7 m -62.12 153.49 6.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.4 96.28 4.98 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.996 0.903 . . . . 0.0 112.226 -175.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -73.83 138.41 44.42 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.503 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.7 m -145.16 134.09 11.1 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 175.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.32 154.92 56.3 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.602 1.535 . . . . 0.0 110.001 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.69 69.75 1.36 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.496 -0.753 . . . . 0.0 110.579 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.8 m -53.89 151.7 6.3 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.082 0.953 . . . . 0.0 110.14 175.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.67 167.71 14.38 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -73.16 21.08 0.34 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.938 3.759 . . . . 0.0 115.237 -168.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -48.38 129.89 16.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.83 1.652 . . . . 0.0 111.073 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.8 p -68.85 117.4 10.48 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.574 1.95 . . . . 0.0 110.94 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 N-CA-C 106.646 -2.581 . . . . 0.0 106.646 177.424 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.831 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 62.86 174.3 0.15 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.422 1.489 . . . . 0.0 114.554 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.5 m -160.67 159.45 30.32 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.882 1.673 . . . . 0.0 108.782 163.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.55 -175.79 30.23 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 124.957 1.265 . . . . 0.0 110.085 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m -123.66 -15.16 7.1 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.841 0.82 . . . . 0.0 112.262 174.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.0 t -149.67 148.78 29.69 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.48 102.0 0.2 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 -166.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -29.03 67.58 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.934 0.894 . . . . 0.0 112.845 -170.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.29 -27.1 66.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.507 0.723 . . . . 0.0 111.708 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -90.61 -32.95 16.05 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.617 -0.677 . . . . 0.0 110.551 177.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.44 -50.23 74.75 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.7 173.2 22.12 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -168.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.94 -170.9 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.441 3.427 . . . . 0.0 111.99 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.9 139.93 33.82 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 159.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 65.24 140.56 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.962 2.105 . . . . 0.0 111.381 -169.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 t 34.13 59.89 0.58 Allowed 'General case' 0 C--O 1.238 0.465 0 C-N-CA 126.865 2.066 . . . . 0.0 112.245 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -38.2 117.1 0.58 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.836 1.655 . . . . 0.0 110.369 173.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.71 146.32 21.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.635 1.174 . . . . 0.0 111.027 -175.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.98 -41.1 21.23 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 124.24 1.016 . . . . 0.0 109.213 163.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.05 113.9 26.29 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.409 0.55 . . . . 0.0 109.607 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.79 58.81 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 124.945 1.298 . . . . 0.0 110.792 -171.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mm? 57.62 -175.95 0.07 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.845 1.258 . . . . 0.0 109.86 -164.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -140.61 73.05 1.41 Allowed 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 170.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.5 p -128.19 87.82 54.41 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -167.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.7 148.26 52.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.823 2.348 . . . . 0.0 112.045 -173.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.0 tppt? -151.53 136.31 17.18 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -64.83 -42.61 94.8 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.311 0.96 . . . . 0.0 109.492 167.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 147.49 -164.23 28.74 Favored Glycine 0 CA--C 1.531 1.036 0 N-CA-C 108.601 -1.799 . . . . 0.0 108.601 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -67.42 170.64 13.14 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.347 2.031 . . . . 0.0 111.14 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 t -154.83 167.35 30.56 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.288 1.435 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.1 p -136.12 170.35 16.16 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.672 0.669 . . . . 0.0 111.426 -175.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 C-N-CA 127.345 2.403 . . . . 0.0 109.051 172.543 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -152.26 163.25 39.81 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 126.72 2.008 . . . . 0.0 106.897 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.0 m -67.74 -76.39 0.09 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 149.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 88.05 -172.24 41.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 -159.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -154.55 -26.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.576 0.75 . . . . 0.0 110.486 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 m -71.77 -75.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 158.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.51 69.71 1.18 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 176.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 ptt? -54.69 -29.8 54.0 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.274 1.029 . . . . 0.0 112.435 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.77 -36.33 37.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.274 1.03 . . . . 0.0 111.027 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -62.14 -35.76 79.76 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.29 -42.53 95.67 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.42 112.51 4.18 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 126.82 2.152 . . . . 0.0 111.247 -171.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.31 -4.4 14.22 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.167 2.578 . . . . 0.0 113.152 -176.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -126.87 95.06 4.21 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.7 1.2 . . . . 0.0 109.186 -174.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.09 75.08 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 108.943 -171.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.7 t -125.63 75.58 1.5 Allowed 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.99 -1.069 . . . . 0.0 109.544 -173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mtpt -71.51 77.13 0.79 Allowed 'General case' 0 C--O 1.238 0.483 0 C-N-CA 123.177 0.591 . . . . 0.0 110.174 168.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 64.48 -79.92 0.03 OUTLIER 'General case' 0 C--O 1.234 0.263 0 C-N-CA 128.63 2.772 . . . . 0.0 112.102 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -138.59 136.92 36.49 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.214 0.916 . . . . 0.0 110.342 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 129.88 15.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.633 2.773 . . . . 0.0 106.593 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -161.85 80.63 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -155.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 tt -133.51 -45.77 0.82 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 117.506 -1.235 . . . . 0.0 112.333 -163.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.7 mttm 49.69 82.37 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.064 1.746 . . . . 0.0 112.107 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.5 t -117.67 135.38 23.28 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 123.406 0.682 . . . . 0.0 111.606 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -80.03 167.26 20.18 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 124.432 3.421 . . . . 0.0 112.0 174.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -140.09 153.42 46.73 Favored 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 109.854 -175.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 m -144.48 170.03 16.82 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 151.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.89 -175.58 11.11 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.51 1.529 . . . . 0.0 113.059 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -80.56 35.09 0.56 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.368 3.379 . . . . 0.0 112.248 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.8 m 65.85 120.81 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.838 1.655 . . . . 0.0 109.689 -149.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 69.58 102.48 0.06 Allowed 'General case' 0 C--O 1.236 0.374 0 C-N-CA 126.278 1.831 . . . . 0.0 110.318 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 173.916 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -124.97 90.92 3.33 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.286 1.434 . . . . 0.0 108.185 -178.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 p -63.6 159.15 19.49 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.623 1.169 . . . . 0.0 110.808 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.22 39.94 95.18 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 123.651 0.643 . . . . 0.0 112.422 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 t -121.96 85.6 2.44 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.809 -1.922 . . . . 0.0 105.809 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.6 p 50.71 177.68 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.487 2.715 . . . . 0.0 113.439 -156.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.22 161.51 19.69 Favored Glycine 0 C--O 1.24 0.512 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.6 ttm -93.77 -28.45 15.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.35 1.06 . . . . 0.0 111.451 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.68 87.75 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 118.567 0.622 . . . . 0.0 109.584 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -57.35 -43.89 83.87 Favored 'General case' 0 C--O 1.23 0.067 0 C-N-CA 125.073 1.349 . . . . 0.0 110.063 172.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HB3' HD21 ' A' ' 52' ' ' LEU . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.456 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 14' ' ' LEU . 4.2 mm? -67.48 -22.48 65.46 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -151.16 77.35 0.23 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.594 1.569 . . . . 0.0 110.022 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -78.24 49.56 3.06 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 124.652 3.568 . . . . 0.0 110.605 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 69.27 145.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 128.322 2.649 . . . . 0.0 111.843 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 42.46 92.02 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 129.374 3.07 . . . . 0.0 114.641 -168.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.76 12.71 29.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.547 -1.346 . . . . 0.0 113.056 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -151.99 130.11 11.91 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 120.656 -1.277 . . . . 0.0 109.364 176.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 45.04 -172.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 111.223 -152.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 mmtm 57.23 26.96 12.89 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.974 -1.079 . . . . 0.0 112.972 170.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -76.79 77.14 3.41 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.16 55.76 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.221 0 C-N-CA 126.066 1.746 . . . . 0.0 107.933 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -123.82 118.62 27.56 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.642 1.977 . . . . 0.0 106.425 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 35.42 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 128.947 2.899 . . . . 0.0 112.422 173.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.7 123.08 9.26 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 126.068 1.747 . . . . 0.0 110.61 -172.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.7 -41.26 32.05 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.08 1.853 . . . . 0.0 113.249 -172.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -156.14 -178.77 7.56 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.234 0.925 . . . . 0.0 109.649 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -144.88 165.41 28.21 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.631 1.572 . . . . 0.0 107.895 168.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 133.47 -170.43 22.32 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -168.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.37 157.7 60.17 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 121.734 1.623 . . . . 0.0 110.138 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -169.39 173.88 6.32 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.793 2.037 . . . . 0.0 108.008 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m 53.18 -150.79 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.52 0.728 . . . . 0.0 111.325 173.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.241 0 N-CA-C 106.524 -2.63 . . . . 0.0 106.524 -151.766 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.856 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -117.39 -31.9 5.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.023 0.929 . . . . 0.0 109.668 163.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.7 p -153.55 179.56 8.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.602 1.561 . . . . 0.0 108.7 167.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.73 -179.35 47.84 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 168.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.6 m 51.2 60.11 4.11 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.657 1.183 . . . . 0.0 112.693 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.0 m -59.01 102.57 0.13 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 164.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -163.91 150.84 19.77 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 126.012 1.768 . . . . 0.0 109.573 -168.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.37 -43.86 96.44 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.152 -0.927 . . . . 0.0 112.764 -163.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.2 -47.16 74.81 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.316 0.962 . . . . 0.0 110.092 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.65 -42.59 98.09 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.048 -0.408 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.81 -65.84 0.61 Allowed 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -58.61 105.48 0.67 Allowed Glycine 0 CA--C 1.525 0.707 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.68 -166.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -65.17 122.22 9.91 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.629 2.219 . . . . 0.0 108.2 -171.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -167.68 -62.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 118.4 -0.809 . . . . 0.0 111.057 -163.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 30.3 78.69 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.982 2.113 . . . . 0.0 112.672 -167.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 87.7 p -123.43 89.3 3.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 171.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -158.09 -176.25 5.81 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.85 0.86 . . . . 0.0 109.599 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -82.38 144.14 30.74 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.252 0.549 . . . . 0.0 110.344 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -67.75 103.52 1.44 Allowed 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.653 1.981 . . . . 0.0 108.137 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -155.52 82.92 1.04 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.712 0.768 . . . . 0.0 109.932 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.2 p -147.66 144.08 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.052 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 tp -143.72 58.57 1.37 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.232 1.013 . . . . 0.0 109.358 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.266 18.9 pttp 43.37 66.63 0.77 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.945 2.098 . . . . 0.0 113.161 -166.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.66 156.81 42.0 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 123.639 0.776 . . . . 0.0 112.139 175.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.43 156.47 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.022 2.481 . . . . 0.0 109.795 169.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -121.96 48.55 1.7 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.449 1.9 . . . . 0.0 108.308 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 61.0 p -47.29 118.03 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.087 1.755 . . . . 0.0 111.014 174.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -121.45 -178.99 15.96 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.039 0.828 . . . . 0.0 112.429 -163.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.18 160.0 40.46 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.502 2.134 . . . . 0.0 110.285 172.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.9 m 40.33 49.78 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.05 2.14 . . . . 0.0 111.377 171.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -100.62 85.32 2.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.309 1.444 . . . . 0.0 107.875 -165.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 -175.82 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -142.45 158.24 43.9 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.924 1.29 . . . . 0.0 108.529 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t 48.22 -159.19 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.833 1.653 . . . . 0.0 110.682 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.46 170.1 42.47 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 120.347 -1.47 . . . . 0.0 112.085 173.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.9 t -77.12 113.43 14.84 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.7 p -145.6 72.98 1.33 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.29 163.14 28.81 Favored Glycine 0 CA--C 1.524 0.639 0 C-N-CA 124.62 1.105 . . . . 0.0 112.026 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -57.54 -42.51 83.06 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.291 1.436 . . . . 0.0 110.513 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.5 -58.67 7.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.269 0.627 . . . . 0.0 110.488 -176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -65.14 -28.0 69.12 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.183 -0.323 . . . . 0.0 111.835 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 21' ' ' GLN . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.69 -15.2 51.38 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.93 81.12 0.55 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 -165.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.96 -28.17 6.32 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.428 2.085 . . . . 0.0 111.583 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -163.4 -63.18 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 126.208 1.803 . . . . 0.0 107.033 176.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 148.72 39.96 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.168 0.987 . . . . 0.0 109.065 169.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m -121.18 164.4 16.96 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.861 0.865 . . . . 0.0 109.061 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 39.3 68.46 0.36 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.691 1.596 . . . . 0.0 111.048 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -60.37 122.07 13.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 168.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -66.3 123.47 20.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.232 0.923 . . . . 0.0 108.538 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.66 162.23 35.6 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.739 0.816 . . . . 0.0 110.825 175.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -69.72 130.76 34.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 166.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 mp -71.54 143.51 49.9 Favored 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 pttm 39.08 68.54 0.35 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.258 1.823 . . . . 0.0 113.302 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.9 t -50.73 138.76 22.72 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 123.312 0.645 . . . . 0.0 111.174 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.03 -7.52 20.0 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.742 2.295 . . . . 0.0 113.432 -176.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -74.66 91.82 2.39 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.444 1.475 . . . . 0.0 107.57 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.3 m -137.45 110.46 7.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.813 2.045 . . . . 0.0 106.275 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -127.09 75.72 0.41 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 118.54 -1.145 . . . . 0.0 111.077 -175.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.77 -9.34 21.05 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.008 2.472 . . . . 0.0 114.987 -172.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 47.47 -98.57 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.962 1.705 . . . . 0.0 112.585 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -146.22 -39.61 0.22 Allowed 'General case' 0 C--N 1.332 -0.169 0 O-C-N 120.928 -1.107 . . . . 0.0 109.374 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 106.375 -2.69 . . . . 0.0 106.375 166.596 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -150.64 176.73 10.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.545 0.738 . . . . 0.0 109.26 161.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 t -128.73 -34.81 1.95 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 126.683 1.993 . . . . 0.0 110.435 -174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.74 -89.76 0.16 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.034 -2.027 . . . . 0.0 108.034 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -165.36 -79.79 0.03 OUTLIER 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 99.13 76.36 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 129.641 3.177 . . . . 0.0 111.606 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -162.44 171.15 38.23 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ttt -89.46 -46.74 8.48 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 168.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.3 -48.22 81.19 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.46 -10.5 59.86 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.671 0.789 . . . . 0.0 111.93 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.558 HD11 ' HE3' ' A' ' 49' ' ' LYS . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.558 ' HE3' HD11 ' A' ' 45' ' ' LEU . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.09 -56.72 18.61 Favored 'General case' 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.58 170.55 11.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 124.49 1.043 . . . . 0.0 111.07 178.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 30.89 0.26 Allowed 'Trans proline' 0 CA--C 1.543 0.936 1 C-N-CA 126.359 4.706 . . . . 0.0 112.344 174.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -51.69 -63.36 1.16 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.889 2.076 . . . . 0.0 110.653 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -145.13 92.45 2.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.1 t -150.54 -31.84 0.18 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.702 0.801 . . . . 0.0 112.576 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 60.26 -5.84 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.895 2.478 . . . . 0.0 115.091 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -110.53 109.27 19.54 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 120.941 -1.099 . . . . 0.0 108.247 -158.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -163.04 77.74 0.44 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.497 1.119 . . . . 0.0 108.581 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -101.58 85.37 2.74 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.544 -0.723 . . . . 0.0 110.098 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.95 126.1 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.33 108.49 4.81 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -134.6 149.32 50.58 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.852 2.061 . . . . 0.0 107.439 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 t -57.09 143.47 72.17 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 166.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.97 67.89 5.83 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.655 2.904 . . . . 0.0 110.782 -175.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -147.76 132.3 17.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 126.816 2.047 . . . . 0.0 107.916 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 60.0 m -161.32 137.81 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.894 1.678 . . . . 0.0 107.707 170.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 127.31 -174.48 18.38 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 118.466 0.576 . . . . 0.0 113.962 171.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.21 170.11 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.245 3.297 . . . . 0.0 110.985 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 54.5 p -139.18 145.16 38.99 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 164.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.34 -35.32 0.25 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.711 2.004 . . . . 0.0 114.935 -175.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 107.815 -2.114 . . . . 0.0 107.815 -176.936 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 48.62 31.62 3.06 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.711 1.605 . . . . 0.0 114.044 165.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.32 128.69 36.27 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 144.23 -159.49 27.7 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -166.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -159.61 172.99 16.8 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.29 1.036 . . . . 0.0 109.513 169.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 m 55.48 64.23 1.83 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.909 1.284 . . . . 0.0 111.086 166.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.37 163.93 34.2 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.9 mtt -67.82 -50.6 55.88 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.77 90.09 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.26 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -56.73 -58.89 6.16 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.769 0.713 . . . . 0.0 109.892 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.499 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.406 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.84 -56.39 15.79 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -53.32 93.68 0.01 OUTLIER Glycine 0 C--N 1.34 0.79 0 C-N-CA 127.31 2.385 . . . . 0.0 110.903 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -77.03 -28.74 5.73 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 CA-C-N 118.61 1.205 . . . . 0.0 112.07 -146.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 t0 175.68 121.79 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 C-N-CA 129.112 2.965 . . . . 0.0 105.798 157.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -139.89 -64.89 0.47 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.417 0.553 . . . . 0.0 110.575 -168.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.252 88.6 p 44.72 -166.23 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.756 2.022 . . . . 0.0 113.4 -169.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -169.35 161.68 10.05 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.208 1.803 . . . . 0.0 109.084 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 59.18 -85.6 0.02 OUTLIER 'General case' 0 C--O 1.237 0.404 0 C-N-CA 127.524 2.33 . . . . 0.0 111.883 176.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -61.08 152.32 28.57 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.708 1.14 . . . . 0.0 108.207 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -114.37 136.67 52.73 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.867 1.667 . . . . 0.0 108.069 -168.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.259 34.0 m 42.73 44.88 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 127.159 2.183 . . . . 0.0 112.839 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -72.74 76.2 1.12 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.072 1.349 . . . . 0.0 109.376 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 ptpp? -65.52 142.58 58.07 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 126.79 2.036 . . . . 0.0 110.612 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.5 p -109.63 153.07 43.12 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 123.977 0.911 . . . . 0.0 111.268 -158.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -76.22 116.29 4.32 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 113.42 -173.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -73.68 48.5 0.28 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.312 2.245 . . . . 0.0 113.422 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -43.94 97.55 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.777 -1.202 . . . . 0.0 110.959 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.17 96.66 1.6 Allowed Glycine 0 CA--C 1.528 0.847 0 CA-C-O 117.689 -1.617 . . . . 0.0 110.876 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.04 125.03 13.45 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 CA-C-N 120.926 2.363 . . . . 0.0 108.217 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.9 t -160.56 142.9 12.85 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.3 1.44 . . . . 0.0 108.24 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.32 -98.17 0.03 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 N-CA-C 109.294 -1.523 . . . . 0.0 109.294 171.666 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.855 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -31.55 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.561 0.744 . . . . 0.0 111.247 170.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -149.43 -177.94 6.14 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.093 1.357 . . . . 0.0 108.633 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.18 13.01 0.03 OUTLIER Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.392 1.949 . . . . 0.0 112.473 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 p -160.48 147.54 15.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 119.962 1.881 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.0 m -145.48 62.21 1.28 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.881 0.872 . . . . 0.0 111.211 169.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.69 172.98 40.21 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 120.777 -1.202 . . . . 0.0 111.598 172.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.0 tmm? -66.72 -51.57 54.42 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 117.366 0.583 . . . . 0.0 109.981 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.22 -46.37 89.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.258 0.623 . . . . 0.0 111.193 -176.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.0 -53.29 58.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 123.154 0.582 . . . . 0.0 109.746 173.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.28 -47.77 82.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -98.53 -170.45 31.67 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.095 1.331 . . . . 0.0 111.194 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.4 -69.07 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.327 2.685 . . . . 0.0 112.34 -167.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -163.26 145.69 10.09 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.08 10.44 3.56 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.346 0.976 . . . . 0.0 112.469 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -56.25 102.87 0.09 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.373 1.069 . . . . 0.0 111.956 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -165.67 94.52 0.6 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -101.6 -9.33 21.06 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -174.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -149.9 -174.92 4.85 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.267 1.427 . . . . 0.0 107.196 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -66.71 112.96 4.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 173.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.1 m -137.26 98.42 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 104.917 -2.253 . . . . 0.0 104.917 170.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 52.6 tp -80.25 82.89 6.21 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.488 1.515 . . . . 0.0 107.607 -173.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -146.94 -178.68 6.32 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.701 1.201 . . . . 0.0 110.109 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.1 t -134.75 157.3 77.5 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 126.415 1.886 . . . . 0.0 107.11 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -73.26 125.49 10.29 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.591 2.194 . . . . 0.0 110.839 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' HE3' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -140.43 140.18 35.38 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.484 1.114 . . . . 0.0 108.227 170.812 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.3 m 59.25 170.9 0.07 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.233 1.813 . . . . 0.0 112.578 -173.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 170.54 176.33 39.87 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -71.68 179.05 5.04 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.71 2.273 . . . . 0.0 109.895 164.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -155.24 -74.57 0.11 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.438 -0.789 . . . . 0.0 109.586 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -171.4 2.5 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 128.809 2.844 . . . . 0.0 106.358 175.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 159.018 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -79.71 96.22 6.18 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 166.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.2 m -59.34 100.26 0.07 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.885 1.274 . . . . 0.0 109.134 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.8 62.89 0.64 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -167.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.7 t -121.78 173.97 7.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.771 1.228 . . . . 0.0 107.777 174.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.9 m -137.12 42.93 2.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.826 1.25 . . . . 0.0 108.934 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.71 130.06 21.83 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 124.385 0.993 . . . . 0.0 110.647 176.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 ttp -66.48 -49.45 66.58 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -174.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.02 -28.64 62.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.968 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.01 -51.64 66.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.702 0.683 . . . . 0.0 109.272 173.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.13 -33.51 67.45 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.41 104.99 2.77 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.59 1.567 . . . . 0.0 109.399 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -72.29 169.31 21.91 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.68 2.253 . . . . 0.0 110.873 -177.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -49.5 139.52 12.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.856 1.262 . . . . 0.0 108.758 159.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -56.05 140.85 42.21 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 167.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.72 2.44 4.16 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.668 -0.645 . . . . 0.0 112.357 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -64.37 136.28 56.97 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.733 1.213 . . . . 0.0 109.299 170.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -67.54 99.02 0.72 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 172.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -142.46 74.93 1.47 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -172.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 49.59 56.43 7.86 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.813 1.645 . . . . 0.0 112.393 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -139.77 79.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 121.123 -0.986 . . . . 0.0 110.151 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mp 53.57 -145.96 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.949 1.3 . . . . 0.0 108.485 -172.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -134.26 64.04 1.61 Allowed 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.78 1.232 . . . . 0.0 109.403 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.3 m 62.95 147.42 0.09 OUTLIER Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 127.034 2.134 . . . . 0.0 111.536 -168.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.81 -61.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.887 2.391 . . . . 0.0 110.74 169.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.69 164.03 37.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 128.07 2.548 . . . . 0.0 108.059 176.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 7.6 t -81.12 164.46 22.38 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.107 0.48 . . . . 0.0 109.826 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.57 168.55 12.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.516 2.007 . . . . 0.0 110.635 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.67 177.3 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.868 2.378 . . . . 0.0 109.81 170.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.4 m -121.88 143.84 49.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 153.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 m 56.83 175.01 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.307 1.043 . . . . 0.0 111.979 -164.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 -163.497 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.534 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.88 85.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.884 1.673 . . . . 0.0 110.03 -168.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t 69.91 171.13 0.31 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.323 1.849 . . . . 0.0 111.695 -173.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 62.1 173.94 1.79 Allowed Glycine 0 CA--C 1.531 1.031 0 C-N-CA 127.187 2.327 . . . . 0.0 115.515 173.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.76 142.91 15.53 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.86 1.264 . . . . 0.0 108.308 174.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 t -150.02 140.57 22.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.038 1.335 . . . . 0.0 108.059 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.76 -177.32 35.62 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.962 173.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -67.67 -71.37 0.21 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.009 0.923 . . . . 0.0 108.973 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.8 -48.74 69.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.063 0.945 . . . . 0.0 112.968 -169.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -68.76 -27.55 65.99 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.557 -0.714 . . . . 0.0 111.181 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' HE3' ' A' ' 49' ' ' LYS . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HE3' HD11 ' A' ' 45' ' ' LEU . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.02 -6.62 4.12 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -90.78 103.41 3.04 Favored Glycine 0 CA--C 1.53 1.029 0 N-CA-C 107.392 -2.283 . . . . 0.0 107.392 158.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.7 55.14 2.64 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 124.086 3.191 . . . . 0.0 110.35 169.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -77.19 169.46 18.29 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.761 1.224 . . . . 0.0 109.142 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.42 115.62 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.1 m -68.18 168.12 12.85 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.921 0.867 . . . . 0.0 110.424 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -52.4 138.08 27.94 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 155.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.2 tm0? -114.29 -31.66 6.21 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 -171.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -146.83 162.44 38.61 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -61.55 104.72 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 119.054 0.843 . . . . 0.0 108.92 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 68.3 t -139.69 65.43 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.3 tp -91.54 168.91 11.18 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -131.12 148.47 52.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 68.05 152.6 0.13 Allowed Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 124.685 1.241 . . . . 0.0 109.91 -165.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -82.28 163.01 17.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 0.0 110.958 175.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -133.99 164.69 26.74 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.39 -0.818 . . . . 0.0 108.872 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.9 t -74.39 99.44 3.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.26 85.18 0.38 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.168 2.318 . . . . 0.0 110.289 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.63 92.76 0.94 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.282 2.654 . . . . 0.0 109.872 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -152.91 118.22 5.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -135.45 -39.73 0.73 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.426 1.49 . . . . 0.0 112.315 -172.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.426 0 C-N-CA 126.696 2.094 . . . . 0.0 108.261 -173.138 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.744 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -69.29 155.31 40.63 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.079 0.951 . . . . 0.0 112.577 -173.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.0 p -143.91 45.08 1.47 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.748 2.019 . . . . 0.0 109.165 -172.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 119.48 170.43 14.52 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -162.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 m -87.61 136.02 33.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 164.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -151.2 90.99 1.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 172.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.81 99.27 0.22 Allowed Glycine 0 CA--C 1.508 -0.37 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -173.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -54.52 -40.26 68.43 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.214 1.006 . . . . 0.0 112.158 -176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.04 -52.82 63.33 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.433 0.561 . . . . 0.0 110.471 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.24 -43.08 99.63 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -60.1 -75.66 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.06 74.39 1.28 Allowed Glycine 0 CA--C 1.53 1.022 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -164.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.51 -46.53 3.82 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.229 1.953 . . . . 0.0 111.255 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -170.31 94.51 0.23 Allowed 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 126.502 1.921 . . . . 0.0 107.293 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.98 136.62 10.16 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.8 m -73.84 104.69 4.81 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -136.04 -63.19 0.66 Allowed 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 124.261 1.024 . . . . 0.0 110.228 -176.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 65.11 -66.77 0.13 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.276 1.83 . . . . 0.0 112.123 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.0 mttm 59.0 17.88 5.8 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.723 2.009 . . . . 0.0 112.358 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -117.38 67.78 0.74 Allowed 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.408 1.483 . . . . 0.0 107.86 -167.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.6 88.36 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' H ' HD23 ' A' ' 63' ' ' LEU . 2.0 pt? -58.29 157.46 8.48 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 168.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -129.71 -6.59 4.59 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.3 t -159.23 148.57 14.57 Favored Pre-proline 0 C--O 1.243 0.717 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.31 94.02 0.91 Allowed 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.333 2.688 . . . . 0.0 108.0 176.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 136.54 57.16 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.44 149.62 22.6 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 167.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.88 177.49 46.71 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.25 95.02 0.49 Allowed 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.376 2.717 . . . . 0.0 110.481 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.4 t -66.01 -176.22 0.38 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.734 0.778 . . . . 0.0 109.078 164.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 p -125.96 130.12 50.62 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.041 1.337 . . . . 0.0 107.886 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.764 0 C-N-CA 124.554 1.073 . . . . 0.0 110.894 -177.084 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.71 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -75.33 173.99 10.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.9 1.68 . . . . 0.0 110.452 170.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.2 p -106.7 -8.2 16.97 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.747 -1.22 . . . . 0.0 112.03 166.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.96 -96.68 0.97 Allowed Glycine 0 C--N 1.337 0.591 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 m -158.51 166.77 31.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 126.595 1.958 . . . . 0.0 107.729 160.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.8 m -138.66 155.66 48.09 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.789 1.236 . . . . 0.0 107.691 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 173.75 61.24 0.05 OUTLIER Glycine 0 C--O 1.225 -0.413 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 177.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.06 -23.91 65.92 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.415 0.607 . . . . 0.0 112.609 -171.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.87 66.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.764 0.711 . . . . 0.0 110.737 171.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -47.87 77.49 Favored 'General case' 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB3' HD21 ' A' ' 52' ' ' LEU . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 14' ' ' LEU . 3.5 mm? -65.9 -15.73 63.21 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -105.62 -165.79 23.5 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.79 1.662 . . . . 0.0 111.328 -170.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -69.08 131.48 22.3 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.354 2.036 . . . . 0.0 107.101 169.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.58 133.71 54.22 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 122.79 0.436 . . . . 0.0 109.895 -169.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -92.23 163.39 13.93 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.206 1.002 . . . . 0.0 110.561 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.72 144.91 46.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.105 0.562 . . . . 0.0 109.527 175.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -150.51 -50.44 0.13 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.347 1.459 . . . . 0.0 110.361 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -159.81 130.89 5.87 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.351 0.661 . . . . 0.0 109.787 -171.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.93 94.44 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 128.477 2.711 . . . . 0.0 112.623 176.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -52.52 148.83 6.45 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 -175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 3.2 m -123.54 93.2 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 124.635 1.174 . . . . 0.0 108.036 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -140.62 104.72 4.79 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.173 1.389 . . . . 0.0 109.917 -175.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.6 mttt 52.12 -155.08 0.17 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.131 1.772 . . . . 0.0 109.563 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.6 p -117.65 150.34 46.66 Favored Pre-proline 0 C--O 1.24 0.58 0 CA-C-N 119.454 1.025 . . . . 0.0 111.981 -166.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.02 -51.36 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 123.026 2.484 . . . . 0.0 109.989 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? 40.69 54.06 3.09 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 126.235 1.814 . . . . 0.0 109.487 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.6 p -144.27 119.32 10.04 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.368 0.667 . . . . 0.0 110.251 -167.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 102.74 -154.65 18.33 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.35 151.92 64.56 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 121.87 1.714 . . . . 0.0 111.633 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 27.4 m -137.55 131.1 31.22 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.834 1.654 . . . . 0.0 107.771 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.3 p -87.37 175.04 8.18 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.592 0.757 . . . . 0.0 110.389 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.98 0 N-CA-C 105.698 -2.961 . . . . 0.0 105.698 179.497 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.0 m -153.05 -39.67 0.1 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.3 m -139.46 -28.25 0.77 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 119.025 0.83 . . . . 0.0 112.661 -174.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.79 146.76 38.95 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 173.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -79.98 65.51 5.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.063 . . . . 0.0 110.237 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.7 t -62.12 123.66 18.73 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 169.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 168.82 -95.3 0.11 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 108.676 -1.77 . . . . 0.0 108.676 -172.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.6 mtm -59.23 -45.69 90.46 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.182 0.991 . . . . 0.0 110.284 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.57 -7.8 3.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -90.55 -51.47 5.38 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 120.611 -1.305 . . . . 0.0 108.892 169.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -68.96 -10.52 57.82 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.35 -133.57 2.99 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -170.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -73.51 82.32 1.68 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.228 2.619 . . . . 0.0 109.278 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.71 146.73 48.33 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.748 1.219 . . . . 0.0 109.772 174.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -134.5 80.26 1.84 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 126.36 1.864 . . . . 0.0 106.83 178.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.3 m -74.13 67.34 1.32 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.345 1.458 . . . . 0.0 111.077 -176.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.59 -22.32 66.13 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.884 -1.135 . . . . 0.0 113.454 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -163.76 158.27 19.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 119.357 0.98 . . . . 0.0 108.802 169.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.19 -178.99 0.22 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.929 2.092 . . . . 0.0 112.477 176.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -124.48 -2.09 8.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.27 2.228 . . . . 0.0 111.807 -174.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.9 t 44.63 68.62 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 125.964 1.705 . . . . 0.0 111.404 174.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.416 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.7 pt? -120.34 172.76 7.58 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.269 1.428 . . . . 0.0 111.878 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.09 -167.9 1.75 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.197 1.399 . . . . 0.0 109.642 -175.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.3 m -141.5 135.31 14.75 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 125.995 1.718 . . . . 0.0 106.715 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.76 130.6 15.98 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 122.737 2.292 . . . . 0.0 107.908 170.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 tttm -152.11 106.46 3.18 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 121.504 -0.747 . . . . 0.0 109.506 -173.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.96 74.07 0.12 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.846 2.459 . . . . 0.0 111.569 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -82.32 109.56 3.08 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.038 -1.423 . . . . 0.0 110.29 174.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.55 112.03 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.56 2.173 . . . . 0.0 108.365 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.2 t -75.34 99.07 4.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 171.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.4 m -76.46 -40.78 49.48 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.412 -0.805 . . . . 0.0 111.506 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.983 0 N-CA-C 107.377 -2.289 . . . . 0.0 107.377 169.534 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.621 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -56.54 162.89 1.99 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 m -64.35 160.62 18.54 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.87 0.468 . . . . 0.0 111.472 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.9 179.92 40.29 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.312 1.911 . . . . 0.0 108.592 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -137.25 167.41 21.63 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.509 1.523 . . . . 0.0 108.335 172.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.1 t -145.26 65.25 1.25 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.436 0.562 . . . . 0.0 110.426 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -155.67 166.41 32.83 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -66.8 -52.82 39.4 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 117.805 0.803 . . . . 0.0 111.009 -174.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.13 -33.31 73.18 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -68.48 -48.59 64.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.751 1.22 . . . . 0.0 109.691 175.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.573 ' HA ' HD12 ' A' ' 28' ' ' LEU . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 25' ' ' VAL . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.89 -55.83 30.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.22 0.18 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 108.839 -1.705 . . . . 0.0 108.839 -166.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -59.97 3.72 0.21 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.91 3.74 . . . . 0.0 115.151 173.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -161.46 -176.29 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.0 2.12 . . . . 0.0 107.835 -167.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -150.56 177.61 9.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 127.912 2.485 . . . . 0.0 107.838 -160.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m 28.58 55.48 0.1 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.612 2.365 . . . . 0.0 116.087 172.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -89.13 147.9 23.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 163.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -70.08 168.36 15.7 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.642 0.777 . . . . 0.0 109.374 160.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.98 166.49 11.35 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 122.264 1.03 . . . . 0.0 111.83 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -154.22 175.83 13.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.969 1.708 . . . . 0.0 107.484 173.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m -83.65 136.53 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 158.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.22 163.14 40.59 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -133.32 160.83 36.17 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 t -158.73 149.38 15.91 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.826 1.25 . . . . 0.0 107.772 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -76.82 152.97 33.0 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.867 1.711 . . . . 0.0 110.903 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.92 176.34 9.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.653 1.981 . . . . 0.0 108.248 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 69.9 m 60.48 -153.93 0.37 Allowed 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.881 1.272 . . . . 0.0 110.14 -173.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.04 174.36 46.71 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 107.877 -2.089 . . . . 0.0 107.877 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -67.37 104.33 0.89 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.194 2.596 . . . . 0.0 108.974 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 75.2 m 56.46 -171.41 0.08 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.145 0.978 . . . . 0.0 111.681 -172.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.9 t -152.64 132.46 13.25 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 N-CA-C 106.314 -2.714 . . . . 0.0 106.314 -164.161 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 p -63.38 163.69 10.31 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.104 0.961 . . . . 0.0 111.838 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.8 t -139.06 160.14 40.49 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 166.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.75 -173.26 22.41 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.567 1.079 . . . . 0.0 111.84 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -141.74 128.78 20.79 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.97 26.81 0.06 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.108 1.763 . . . . 0.0 113.392 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.69 129.76 9.15 Favored Glycine 0 C--N 1.333 0.364 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.64 -38.76 88.87 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.317 1.059 . . . . 0.0 109.771 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.83 94.32 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.389 1.875 . . . . 0.0 112.02 171.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -63.54 -42.4 98.41 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 121.301 -0.874 . . . . 0.0 110.624 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.78 -35.86 81.23 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.61 103.48 2.32 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.663 1.601 . . . . 0.0 109.542 -169.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -70.66 155.46 62.94 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.236 1.958 . . . . 0.0 110.43 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 53.89 59.23 4.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.658 1.583 . . . . 0.0 110.925 168.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.92 117.63 11.74 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -79.09 85.6 4.98 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -139.62 156.92 46.57 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -70.5 154.91 41.38 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -76.72 98.04 4.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.593 0.757 . . . . 0.0 111.253 -175.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -76.47 -10.37 59.35 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.821 -1.174 . . . . 0.0 111.62 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.7 t 51.2 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.23 1.812 . . . . 0.0 110.988 168.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 tt -144.68 94.64 2.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.078 -1.014 . . . . 0.0 108.855 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.36 114.83 4.54 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 162.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.2 m -61.58 153.47 70.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 165.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.65 -166.96 0.12 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.78 2.987 . . . . 0.0 112.12 165.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -131.53 -27.44 1.94 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.947 1.699 . . . . 0.0 110.688 164.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.8 m -147.69 167.11 25.47 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 119.457 1.026 . . . . 0.0 109.663 171.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.39 -175.81 43.33 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.157 1.361 . . . . 0.0 110.792 167.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.63 -71.02 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.221 3.28 . . . . 0.0 111.061 174.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.2 t -147.16 116.48 6.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 104.791 -2.299 . . . . 0.0 104.791 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.5 m -81.29 36.55 0.42 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.784 1.234 . . . . 0.0 112.009 -175.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.382 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.462 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.428 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -63.54 174.51 1.3 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.41 1.484 . . . . 0.0 113.056 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.6 t -126.75 -68.74 0.79 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.39 1.876 . . . . 0.0 106.934 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.64 -102.01 0.62 Allowed Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 165.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.9 m 36.78 59.8 1.0 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.842 2.057 . . . . 0.0 112.424 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.5 t -71.69 165.22 24.45 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 122.27 1.033 . . . . 0.0 110.992 -176.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.75 156.83 12.5 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 127.502 2.477 . . . . 0.0 107.42 173.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.4 ttt -68.57 -41.46 79.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 118.237 1.019 . . . . 0.0 110.386 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.12 96.2 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 123.529 0.732 . . . . 0.0 110.288 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.85 -48.3 80.19 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.543 1.137 . . . . 0.0 109.841 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.99 -60.11 3.7 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.49 141.17 3.98 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.16 -35.64 14.0 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 121.658 1.572 . . . . 0.0 111.295 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -98.6 70.95 1.96 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-O 122.108 0.956 . . . . 0.0 110.091 -162.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -155.66 46.7 0.49 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.318 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.37 -16.92 4.8 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -154.99 161.2 41.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.048 1.295 . . . . 0.0 109.497 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -136.87 160.94 37.39 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.045 0.938 . . . . 0.0 108.777 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -90.58 -26.91 19.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.874 0.87 . . . . 0.0 111.244 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -69.54 125.5 26.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 162.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 70.2 t -131.8 93.52 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.35 142.72 58.13 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -85.39 -69.82 0.63 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 165.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 p -57.47 156.33 16.69 Favored Pre-proline 0 CA--C 1.54 0.572 0 C-N-CA 124.276 1.031 . . . . 0.0 111.551 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.91 176.41 9.5 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.242 1.961 . . . . 0.0 109.743 -174.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -157.94 161.31 38.18 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.082 -1.011 . . . . 0.0 109.197 174.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 70.27 -0.81 2.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.082 2.153 . . . . 0.0 114.783 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -117.93 60.83 0.46 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-O 117.938 -1.479 . . . . 0.0 111.797 165.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -60.04 -47.53 14.94 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.807 3.005 . . . . 0.0 113.267 -172.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -162.76 135.86 5.81 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.604 1.961 . . . . 0.0 106.193 166.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -173.9 112.81 0.19 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 105.0 -2.222 . . . . 0.0 105.0 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 N-CA-C 104.165 -3.574 . . . . 0.0 104.165 176.241 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.799 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 t -138.32 156.81 47.28 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.202 1.001 . . . . 0.0 110.73 170.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.9 t -155.62 -13.2 0.11 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.006 2.122 . . . . 0.0 110.917 159.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.97 -77.7 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 CA-C-N 119.084 0.856 . . . . 0.0 111.814 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 m -61.52 143.86 55.24 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.68 . . . . 0.0 110.226 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 p -113.65 95.24 5.24 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.39 116.46 4.72 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 173.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -57.73 -28.25 63.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.773 1.287 . . . . 0.0 112.553 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -56.81 16.74 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.77 -30.85 71.56 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.983 0.913 . . . . 0.0 111.131 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.84 -10.16 26.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.64 97.98 1.77 Allowed Glycine 0 CA--C 1.53 1.017 0 CA-C-N 120.277 1.399 . . . . 0.0 110.729 177.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -68.18 137.45 40.51 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.227 1.951 . . . . 0.0 109.757 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -65.79 156.2 33.88 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.876 0.471 . . . . 0.0 110.535 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -135.18 87.06 2.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.589 0.756 . . . . 0.0 109.182 -156.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.5 p -138.14 -83.98 0.3 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 124.038 0.935 . . . . 0.0 109.016 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -64.86 118.92 9.73 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 35.44 66.96 0.3 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 126.808 2.043 . . . . 0.0 111.964 -174.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -82.7 158.75 22.79 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.332 159.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -156.54 100.51 1.95 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 m -140.68 139.24 35.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.193 0.597 . . . . 0.0 110.65 -164.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.5 tp -122.17 -93.54 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 117.23 -1.366 . . . . 0.0 108.884 170.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -139.08 80.75 1.8 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 126.267 1.827 . . . . 0.0 108.128 -171.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.1 p -141.64 97.81 6.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.408 -168.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.97 -31.5 55.88 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.266 1.311 . . . . 0.0 111.239 168.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 tttt 42.77 47.13 4.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.604 1.961 . . . . 0.0 111.265 -172.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -143.88 158.08 43.93 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.397 1.879 . . . . 0.0 108.593 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -157.04 103.61 0.24 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.24 -56.61 0.07 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.152 1.901 . . . . 0.0 110.145 -174.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -156.15 -70.98 0.11 Allowed 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 m 66.46 15.08 10.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.861 1.264 . . . . 0.0 113.061 -176.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 105.912 -2.875 . . . . 0.0 105.912 162.938 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.234 0.244 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 119.812 -0.137 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 119.258 -0.401 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 . . . . . 0 C--O 1.23 0.067 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HB3' HD21 ' A' ' 52' ' ' LEU . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.456 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 14' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.235 0.306 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 . . . . . 0 C--O 1.234 0.285 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 21' ' ' GLN . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.558 HD11 ' HE3' ' A' ' 49' ' ' LYS . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.558 ' HE3' HD11 ' A' ' 45' ' ' LEU . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 . . . . . 0 N--CA 1.465 0.286 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.499 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.406 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 CA--C 1.521 -0.156 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' HE3' ' A' ' 49' ' ' LYS . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HE3' HD11 ' A' ' 45' ' ' LEU . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 . . . . . 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 . . . . . 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB3' HD21 ' A' ' 52' ' ' LEU . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 14' ' ' LEU . 3.5 mm? . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 . . . . . 0 N--CA 1.455 -0.218 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.573 ' HA ' HD12 ' A' ' 28' ' ' LEU . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 25' ' ' VAL . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 . . . . . 0 C--O 1.233 0.21 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 N--CA 1.455 -0.199 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 111.131 0.049 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.07 0 CA-C-O 119.552 -0.582 . . . . 0.0 111.729 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.7 m -142.62 97.53 3.13 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.578 -2.008 . . . . 0.0 105.578 160.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.6 t -159.45 160.82 35.2 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.395 1.078 . . . . 0.0 109.42 -170.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.96 166.97 40.39 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 127.205 2.335 . . . . 0.0 111.394 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 p -149.66 120.71 7.71 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 161.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.55 30.63 1.74 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.618 1.967 . . . . 0.0 114.175 -176.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.96 128.07 28.37 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 156.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.9 ttm -70.9 -46.29 62.82 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.11 97.47 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.215 0.462 . . . . 0.0 110.982 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -40.02 91.21 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.579 -0.701 . . . . 0.0 111.306 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -65.82 -42.03 91.09 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 117.942 -1.028 . . . . 0.0 110.052 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.38 -44.48 92.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.978 1.263 . . . . 0.0 110.73 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -33.96 76.77 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.635 0.652 . . . . 0.0 112.087 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mt -68.51 -46.34 69.89 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 123.866 0.867 . . . . 0.0 109.638 175.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -62.38 -32.77 73.62 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 125.082 1.353 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -58.7 -48.61 80.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.652 0.781 . . . . 0.0 110.038 169.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.47 -43.97 89.12 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.765 0.711 . . . . 0.0 109.332 175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.41 -50.04 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.358 0.981 . . . . 0.0 110.166 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -57.34 -58.03 10.02 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.545 1.538 . . . . 0.0 108.899 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.24 90.32 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.011 1.324 . . . . 0.0 110.394 -173.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -62.38 -48.06 81.39 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.444 1.02 . . . . 0.0 108.975 173.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.55 -37.46 92.59 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.015 0.817 . . . . 0.0 112.629 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -67.97 -46.97 69.89 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.532 1.133 . . . . 0.0 110.408 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -59.98 -47.19 86.82 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.212 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.79 -43.62 67.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 111.8 175.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -63.05 -48.2 79.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.5 -50.43 53.13 Favored Glycine 0 C--O 1.218 -0.897 0 CA-C-O 118.314 -1.27 . . . . 0.0 110.63 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.53 -43.46 89.22 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 120.362 2.081 . . . . 0.0 111.689 -175.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -60.52 -41.25 94.03 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.202 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.5 -43.24 90.74 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.421 1.088 . . . . 0.0 110.676 172.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -80.2 2.17 25.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.387 1.475 . . . . 0.0 111.587 -163.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 43.75 50.58 6.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.172 1.389 . . . . 0.0 110.904 -166.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.17 173.04 7.1 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.675 -0.64 . . . . 0.0 109.325 167.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 m -48.41 120.5 3.7 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.257 1.023 . . . . 0.0 109.527 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.35 -29.15 63.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.567 0.747 . . . . 0.0 110.627 170.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -70.27 -29.82 66.69 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 126.257 1.823 . . . . 0.0 112.841 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 tp -80.26 -47.36 14.7 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.622 1.169 . . . . 0.0 108.771 171.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.8 mt -45.8 -59.62 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 124.779 1.232 . . . . 0.0 109.853 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.37 -24.48 67.86 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 120.547 1.521 . . . . 0.0 114.377 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -76.58 -40.98 47.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.825 0.85 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -72.24 -27.05 62.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.45 -38.41 52.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 126.559 1.944 . . . . 0.0 109.805 171.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.13 -39.24 89.72 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 119.294 0.952 . . . . 0.0 109.597 174.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -63.91 -39.69 94.76 Favored 'General case' 0 N--CA 1.462 0.154 0 O-C-N 121.311 -0.868 . . . . 0.0 111.415 171.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 tp -61.39 -33.51 73.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.45 -0.781 . . . . 0.0 111.207 173.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.6 mt -69.63 -54.05 15.79 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 125.054 1.341 . . . . 0.0 110.512 172.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -52.38 -55.29 22.65 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.377 1.471 . . . . 0.0 110.544 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.1 mt -57.44 -53.63 55.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 118.645 -0.693 . . . . 0.0 110.978 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -55.42 -37.51 67.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.201 1.364 . . . . 0.0 111.863 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.57 -2.89 15.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.988 0.915 . . . . 0.0 113.439 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -94.83 -42.32 8.77 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.813 1.245 . . . . 0.0 110.914 166.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.24 -52.2 65.31 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.694 0.798 . . . . 0.0 110.228 173.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.67 88.97 2.09 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.601 1.572 . . . . 0.0 109.548 -175.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.47 168.93 23.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.075 2.516 . . . . 0.0 111.78 -172.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.72 149.73 46.64 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 122.768 0.427 . . . . 0.0 109.866 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.46 68.28 2.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 126.348 1.859 . . . . 0.0 111.33 -176.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 56.0 m -77.11 79.44 3.64 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.063 -1.023 . . . . 0.0 110.843 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 33.5 tttt 63.61 154.71 0.05 Allowed 'General case' 0 C--O 1.241 0.613 0 C-N-CA 130.798 3.639 . . . . 0.0 112.008 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.6 pm0 -62.4 164.19 7.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 110.903 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -144.16 -69.03 0.31 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.073 0.949 . . . . 0.0 109.962 -173.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 53.0 27.54 5.73 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -173.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.69 125.46 19.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 165.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.37 174.82 3.06 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.766 0.793 . . . . 0.0 110.924 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -136.98 167.11 22.14 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.728 1.211 . . . . 0.0 110.362 174.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.59 160.08 4.28 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.648 1.979 . . . . 0.0 110.489 165.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -73.72 88.97 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.786 2.324 . . . . 0.0 110.875 -170.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt 46.67 56.17 6.86 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.561 1.544 . . . . 0.0 110.957 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.7 p -55.94 -34.9 66.08 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 52.42 52.77 35.25 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-O 117.454 -1.748 . . . . 0.0 114.226 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.81 95.63 0.65 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.417 2.745 . . . . 0.0 110.504 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 t -85.27 -152.74 0.16 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 170.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.4 t -163.45 167.35 21.68 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.455 0 C-N-CA 124.917 1.246 . . . . 0.0 110.0 174.949 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.559 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.8 t -150.9 94.26 2.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 t -60.75 114.99 3.32 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.65 -170.32 34.64 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 108.082 -2.007 . . . . 0.0 108.082 -168.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.1 t -45.99 110.87 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 110.418 -178.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.2 m -144.63 166.38 25.34 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 109.437 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.46 -23.8 0.57 Allowed Glycine 0 CA--C 1.522 0.516 0 CA-C-O 118.937 -0.924 . . . . 0.0 112.889 174.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -51.85 65.49 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.898 1.349 . . . . 0.0 108.914 174.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.78 -35.88 79.45 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.197 0.523 . . . . 0.0 111.279 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.96 -27.6 64.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.692 0.797 . . . . 0.0 111.046 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -76.23 -45.82 31.14 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.987 0.915 . . . . 0.0 109.814 170.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -38.83 75.9 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.879 0.763 . . . . 0.0 111.852 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.54 -37.39 83.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.512 0.725 . . . . 0.0 111.661 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -79.44 -38.51 34.5 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.39 -39.47 79.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.911 0.885 . . . . 0.0 110.251 170.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.67 -52.53 64.56 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 119.685 1.13 . . . . 0.0 110.158 174.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -57.79 -45.52 85.92 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 118.943 -0.551 . . . . 0.0 110.598 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -62.44 -49.74 82.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 124.28 1.032 . . . . 0.0 110.642 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.62 -53.42 58.23 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.865 1.266 . . . . 0.0 109.833 -177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.43 -32.71 74.47 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.604 1.561 . . . . 0.0 111.486 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -67.62 -48.61 66.28 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 109.282 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.61 96.34 Favored Glycine 0 CA--C 1.524 0.594 0 CA-C-O 118.914 -0.937 . . . . 0.0 111.759 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.04 -50.1 75.37 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 175.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.0 ttt180 -59.29 -51.28 70.61 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.64 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.4 t -56.46 -48.54 79.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 124.356 1.063 . . . . 0.0 110.068 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -60.24 -38.89 84.82 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.35 -49.42 61.23 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-O 118.754 -1.026 . . . . 0.0 111.379 174.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -63.42 -38.52 91.44 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.976 1.888 . . . . 0.0 110.821 -175.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -59.08 -48.72 80.57 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.962 0.505 . . . . 0.0 111.505 172.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -62.19 -41.9 98.79 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.333 1.453 . . . . 0.0 110.779 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -67.42 -3.63 8.92 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.886 2.074 . . . . 0.0 112.647 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.8 mtpt 41.22 53.16 3.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 127.214 2.205 . . . . 0.0 110.011 -167.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.33 171.1 2.02 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.686 166.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.7 m -61.97 144.73 54.66 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.878 0.471 . . . . 0.0 112.137 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.24 -48.4 81.74 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -67.61 -28.88 68.11 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 112.708 0.632 . . . . 0.0 112.708 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.5 tp -65.25 -51.72 59.07 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.41 -43.21 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.21 -34.53 78.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.079 -1.013 . . . . 0.0 111.344 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.83 -55.8 30.48 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.608 -0.683 . . . . 0.0 110.413 173.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -23.92 50.95 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.03 -0.986 . . . . 0.0 113.414 -174.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 46.2 t -67.65 -49.52 69.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 119.865 1.211 . . . . 0.0 109.155 168.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.31 -34.58 76.87 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.459 1.027 . . . . 0.0 110.733 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -66.82 -42.62 85.55 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.726 1.148 . . . . 0.0 112.257 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.0 tp -55.49 -44.13 76.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.091 0.956 . . . . 0.0 109.922 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.38 -47.17 82.38 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 118.514 0.597 . . . . 0.0 110.41 173.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -57.83 -40.43 80.02 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.974 0.806 . . . . 0.0 110.989 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.7 mt -65.38 -54.87 22.49 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 122.806 0.442 . . . . 0.0 110.301 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -55.41 -33.21 63.32 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.776 0.716 . . . . 0.0 111.488 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.4 -23.91 63.01 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.61 0.764 . . . . 0.0 112.497 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -84.83 -41.9 15.63 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 124.744 1.218 . . . . 0.0 110.333 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.93 -8.47 7.2 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.544 1.538 . . . . 0.0 113.102 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 146.13 97.45 0.21 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.21 -29.13 47.49 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 CA-C-N 119.929 1.864 . . . . 0.0 111.194 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 46.66 -69.0 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 130.923 3.689 . . . . 0.0 116.884 172.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -70.82 74.42 0.6 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.344 1.458 . . . . 0.0 108.817 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.8 t -90.51 152.08 21.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -147.59 -176.23 5.17 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 126.585 1.954 . . . . 0.0 106.305 -178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -130.26 111.39 12.34 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.209 0.913 . . . . 0.0 109.768 171.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -135.73 -179.74 5.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.554 1.942 . . . . 0.0 108.079 165.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -143.88 -11.3 0.67 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 166.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.279 14.3 p 44.59 50.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 126.29 1.836 . . . . 0.0 113.166 169.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.57 128.08 7.11 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.778 -1.201 . . . . 0.0 108.863 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.6 pttt -68.54 5.57 1.02 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.2 t -150.37 145.18 18.24 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.69 -177.11 3.62 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.465 2.777 . . . . 0.0 110.282 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 64.7 tttt -121.7 10.95 10.42 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.513 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.2 m -19.9 95.2 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 129.103 2.961 . . . . 0.0 113.866 -174.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -178.65 72.45 0.07 OUTLIER Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 -171.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.27 134.51 33.9 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.331 2.021 . . . . 0.0 109.03 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 t -154.84 -50.76 0.09 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.9 m 68.35 18.64 9.09 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 163.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.864 0 N-CA-C 107.519 -2.232 . . . . 0.0 107.519 178.534 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.231 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -153.62 58.55 0.75 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.918 1.287 . . . . 0.0 107.759 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.2 m -74.75 76.55 2.08 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.364 1.066 . . . . 0.0 109.884 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.41 -171.0 44.16 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 123.985 0.802 . . . . 0.0 111.85 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p 35.68 58.06 0.89 Allowed 'General case' 0 C--O 1.235 0.334 0 C-N-CA 128.24 2.616 . . . . 0.0 113.279 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.9 m -144.77 153.8 42.05 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.265 1.026 . . . . 0.0 109.106 171.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.35 72.4 0.01 OUTLIER Glycine 0 C--N 1.333 0.361 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 39.5 mtt -71.27 -31.18 67.19 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -168.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.8 -45.38 78.57 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.923 0.783 . . . . 0.0 109.238 176.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -48.59 74.23 Favored 'General case' 0 C--O 1.227 -0.106 0 C-N-CA 125.161 1.384 . . . . 0.0 110.514 173.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.37 -49.62 75.58 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 118.78 -0.629 . . . . 0.0 110.111 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.41 94.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.137 0.426 . . . . 0.0 111.721 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.33 -31.66 72.31 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.206 0.603 . . . . 0.0 111.319 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.06 -29.18 17.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.869 0.867 . . . . 0.0 112.369 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -58.22 -44.24 88.11 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 166.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.53 -51.34 63.17 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.376 1.07 . . . . 0.0 111.685 172.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.94 -46.22 90.09 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-O 118.716 -0.659 . . . . 0.0 110.292 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.43 -51.14 75.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 CA-C-N 119.473 1.033 . . . . 0.0 109.636 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -57.2 -52.67 64.39 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.4 1.48 . . . . 0.0 110.158 -175.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.24 -40.12 86.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.47 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -64.62 -40.61 95.79 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.254 1.388 . . . . 0.0 109.619 178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.53 -47.84 79.65 Favored Glycine 0 CA--C 1.527 0.782 0 O-C-N 121.078 -1.014 . . . . 0.0 110.978 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -54.23 -55.47 27.76 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 125.301 1.44 . . . . 0.0 109.843 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -56.76 -44.76 82.08 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 110.8 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 29.2 t -59.78 -48.36 87.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 121.201 1.819 . . . . 0.0 110.519 174.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -61.39 -31.93 71.84 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.846 0.859 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.96 -41.87 17.57 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-O 117.976 -1.458 . . . . 0.0 112.446 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 38.7 mt -60.69 -40.53 92.51 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.936 1.868 . . . . 0.0 109.849 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -58.27 -50.69 72.69 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.984 0.514 . . . . 0.0 109.909 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -57.78 -42.13 83.46 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.884 0.765 . . . . 0.0 110.907 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.89 -8.47 53.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.952 0.901 . . . . 0.0 111.252 -174.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.1 mttt 52.87 51.17 16.44 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.485 1.114 . . . . 0.0 110.695 -168.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.62 165.92 18.27 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.457 164.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.9 m -64.9 148.36 51.61 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.916 0.886 . . . . 0.0 111.84 -175.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.46 98.84 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.573 1.149 . . . . 0.0 111.269 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -61.51 -44.15 97.59 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.913 0.485 . . . . 0.0 111.307 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.5 tp -58.57 -49.48 77.29 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 55.6 mt -63.73 -41.6 93.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.542 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.47 -39.54 91.28 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 120.285 1.402 . . . . 0.0 110.943 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -66.11 -48.49 70.7 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 117.863 0.302 . . . . 0.0 110.198 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.47 -33.4 75.8 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.026 0.93 . . . . 0.0 111.452 -177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.5 -48.13 48.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 125.042 1.337 . . . . 0.0 109.988 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.65 83.61 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 120.134 1.334 . . . . 0.0 109.695 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -66.0 -33.11 75.07 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.72 177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.9 tp -64.62 -49.5 70.83 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 125.275 1.43 . . . . 0.0 110.533 169.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.2 mt -63.86 -48.19 77.71 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 123.79 0.836 . . . . 0.0 110.6 -172.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 pttp -71.3 -24.56 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.629 -0.701 . . . . 0.0 112.246 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.78 -58.69 7.47 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 119.059 0.845 . . . . 0.0 108.893 165.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -52.24 -39.14 59.92 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.442 0.697 . . . . 0.0 111.645 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.02 -18.13 59.53 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -94.27 -28.03 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.134 1.373 . . . . 0.0 112.567 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.32 -60.63 3.48 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 158.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 179.32 -158.47 22.47 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 119.325 0.966 . . . . 0.0 112.353 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 136.49 25.87 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.637 2.891 . . . . 0.0 111.355 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -105.29 -27.51 11.47 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.257 1.023 . . . . 0.0 110.98 168.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 49.21 67.98 0.79 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.9 1.68 . . . . 0.0 112.65 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 p -59.54 114.75 2.87 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 156.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 140.34 55.64 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 160.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 53.92 -168.1 0.07 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.347 1.059 . . . . 0.0 110.705 -169.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? 44.13 55.96 5.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 127.056 2.142 . . . . 0.0 112.011 173.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -64.67 118.93 9.62 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.7 m -62.12 153.49 6.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.608 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.4 96.28 4.98 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.996 0.903 . . . . 0.0 112.226 -175.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -73.83 138.41 44.42 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.503 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.7 m -145.16 134.09 11.1 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 175.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.32 154.92 56.3 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 121.602 1.535 . . . . 0.0 110.001 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.69 69.75 1.36 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.496 -0.753 . . . . 0.0 110.579 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.8 m -53.89 151.7 6.3 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.082 0.953 . . . . 0.0 110.14 175.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.67 167.71 14.38 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -73.16 21.08 0.34 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 124.938 3.759 . . . . 0.0 115.237 -168.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -48.38 129.89 16.11 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.83 1.652 . . . . 0.0 111.073 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.8 p -68.85 117.4 10.48 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.574 1.95 . . . . 0.0 110.94 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 N-CA-C 106.646 -2.581 . . . . 0.0 106.646 177.424 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.831 0 N-CA-C 110.421 -1.072 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 62.86 174.3 0.15 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.422 1.489 . . . . 0.0 114.554 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.5 m -160.67 159.45 30.32 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 125.882 1.673 . . . . 0.0 108.782 163.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.55 -175.79 30.23 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 124.957 1.265 . . . . 0.0 110.085 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m -123.66 -15.16 7.1 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.841 0.82 . . . . 0.0 112.262 174.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.0 t -149.67 148.78 29.69 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.48 102.0 0.2 Allowed Glycine 0 C--N 1.332 0.308 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 -166.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -29.03 67.58 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.934 0.894 . . . . 0.0 112.845 -170.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.29 -27.1 66.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.507 0.723 . . . . 0.0 111.708 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -90.61 -32.95 16.05 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.617 -0.677 . . . . 0.0 110.551 177.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.1 -43.79 87.3 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 169.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.02 77.16 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.401 1.08 . . . . 0.0 111.97 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.77 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 122.901 0.48 . . . . 0.0 111.277 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.27 -37.6 74.9 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 119.481 -0.295 . . . . 0.0 110.582 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.15 -30.72 70.56 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.537 0.735 . . . . 0.0 110.133 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -69.41 -48.25 61.61 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 119.895 1.225 . . . . 0.0 109.753 174.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.29 -45.78 69.07 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.752 0.706 . . . . 0.0 109.496 176.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.3 t -58.87 -57.33 11.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 125.217 1.407 . . . . 0.0 111.424 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.0 tttp -56.57 -53.98 51.2 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 125.077 1.351 . . . . 0.0 108.974 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.68 -43.46 97.67 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.01 1.324 . . . . 0.0 110.272 -177.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.24 -45.09 95.99 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.955 0.798 . . . . 0.0 109.557 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.26 -42.27 97.92 Favored Glycine 0 CA--C 1.526 0.776 0 O-C-N 121.608 -0.683 . . . . 0.0 112.155 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -60.12 -38.35 82.77 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 126.075 1.75 . . . . 0.0 110.84 174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -47.32 64.28 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.518 -0.754 . . . . 0.0 110.195 175.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.07 -52.2 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 119.898 1.226 . . . . 0.0 111.249 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -60.93 -48.33 82.32 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.913 -0.565 . . . . 0.0 110.129 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.86 -34.82 90.06 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.403 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.2 mt -63.36 -44.38 94.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.945 1.872 . . . . 0.0 110.229 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.3 mttm -64.98 -28.62 69.64 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 123.456 0.702 . . . . 0.0 111.577 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -75.5 -36.75 60.51 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.373 -0.829 . . . . 0.0 110.654 168.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -76.41 5.6 6.95 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.344 1.058 . . . . 0.0 112.203 -165.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.1 pttt 50.47 39.13 20.11 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.245 1.818 . . . . 0.0 111.868 -169.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.6 166.17 22.41 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.424 -0.797 . . . . 0.0 111.163 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 m -65.37 142.77 58.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.006 0.922 . . . . 0.0 111.634 -176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.18 -33.25 70.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.638 0.775 . . . . 0.0 112.362 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -80.57 -30.93 36.95 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 121.866 -0.521 . . . . 0.0 111.914 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.2 tp -64.87 -42.16 95.07 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 168.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 28.7 mt -63.96 -42.99 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.47 -177.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -60.68 -43.58 97.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.843 0.857 . . . . 0.0 111.203 173.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -54.9 41.76 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 122.005 0.907 . . . . 0.0 109.229 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.91 -28.43 66.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.65 -0.656 . . . . 0.0 111.163 -172.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.6 t -74.88 -43.53 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 119.215 0.916 . . . . 0.0 111.193 173.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.17 82.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 175.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -60.63 -42.37 96.77 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.712 0.805 . . . . 0.0 112.22 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 tp -53.86 -50.92 65.21 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.349 1.06 . . . . 0.0 109.333 172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.1 -48.48 80.05 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.676 1.191 . . . . 0.0 111.635 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -47.99 82.69 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.326 0.966 . . . . 0.0 109.905 -177.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.09 -46.19 88.91 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.655 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -59.57 -34.43 72.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.926 1.239 . . . . 0.0 110.903 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.53 -12.88 61.86 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -86.08 -39.43 16.78 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 119.991 1.269 . . . . 0.0 110.952 172.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.44 -50.23 74.75 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.7 173.2 22.12 Favored Glycine 0 CA--C 1.531 1.05 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 -168.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.94 -170.9 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.441 3.427 . . . . 0.0 111.99 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.9 139.93 33.82 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 159.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 65.24 140.56 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.962 2.105 . . . . 0.0 111.381 -169.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.6 t 34.13 59.89 0.58 Allowed 'General case' 0 C--O 1.238 0.465 0 C-N-CA 126.865 2.066 . . . . 0.0 112.245 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -38.2 117.1 0.58 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.836 1.655 . . . . 0.0 110.369 173.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.71 146.32 21.48 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.635 1.174 . . . . 0.0 111.027 -175.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -81.98 -41.1 21.23 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 124.24 1.016 . . . . 0.0 109.213 163.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -93.05 113.9 26.29 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.409 0.55 . . . . 0.0 109.607 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 m -146.79 58.81 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 124.945 1.298 . . . . 0.0 110.792 -171.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mm? 57.62 -175.95 0.07 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.845 1.258 . . . . 0.0 109.86 -164.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -140.61 73.05 1.41 Allowed 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 170.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 2.5 p -128.19 87.82 54.41 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -167.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.7 148.26 52.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.823 2.348 . . . . 0.0 112.045 -173.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.0 tppt? -151.53 136.31 17.18 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -64.83 -42.61 94.8 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.311 0.96 . . . . 0.0 109.492 167.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 147.49 -164.23 28.74 Favored Glycine 0 CA--C 1.531 1.036 0 N-CA-C 108.601 -1.799 . . . . 0.0 108.601 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -67.42 170.64 13.14 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.347 2.031 . . . . 0.0 111.14 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 t -154.83 167.35 30.56 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.288 1.435 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.1 p -136.12 170.35 16.16 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.672 0.669 . . . . 0.0 111.426 -175.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 C-N-CA 127.345 2.403 . . . . 0.0 109.051 172.543 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -152.26 163.25 39.81 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 126.72 2.008 . . . . 0.0 106.897 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.0 m -67.74 -76.39 0.09 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 149.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 88.05 -172.24 41.68 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 -159.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -154.55 -26.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.576 0.75 . . . . 0.0 110.486 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 m -71.77 -75.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 158.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.51 69.71 1.18 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 176.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.6 ptt? -54.69 -29.8 54.0 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.274 1.029 . . . . 0.0 112.435 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.77 -36.33 37.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.274 1.03 . . . . 0.0 111.027 -178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -62.14 -35.76 79.76 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 ttt-85 -68.67 -55.36 11.7 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 117.874 -1.06 . . . . 0.0 109.745 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.12 -39.12 66.15 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.114 0.965 . . . . 0.0 111.789 -177.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.93 92.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.817 0.847 . . . . 0.0 112.487 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -40.12 73.19 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.663 0.665 . . . . 0.0 109.756 175.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -60.46 -26.51 66.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.709 1.204 . . . . 0.0 110.27 175.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -66.76 -43.48 83.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 121.296 -0.878 . . . . 0.0 110.635 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.8 -46.28 91.15 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.51 -49.96 75.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 123.806 0.842 . . . . 0.0 111.067 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.36 -57.99 10.04 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 117.972 -1.013 . . . . 0.0 108.85 -177.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.22 -36.48 82.1 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.416 -176.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.1 -44.52 97.23 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.883 1.22 . . . . 0.0 110.236 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.73 -53.38 46.63 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 123.901 0.762 . . . . 0.0 111.478 174.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -44.44 81.84 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.749 1.22 . . . . 0.0 109.881 179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -60.33 -54.58 43.99 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-O 116.796 -1.573 . . . . 0.0 109.392 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.76 -50.55 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 121.121 1.782 . . . . 0.0 109.942 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -61.68 -33.46 74.02 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.52 0.728 . . . . 0.0 111.377 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.25 -39.09 23.99 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-O 118.362 -1.243 . . . . 0.0 111.914 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.0 mt -61.17 -44.04 97.94 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.257 1.529 . . . . 0.0 109.042 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -53.23 -54.68 32.59 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 122.599 0.359 . . . . 0.0 110.563 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.12 -39.58 82.73 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 118.88 0.764 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.46 4.82 1.2 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.678 1.991 . . . . 0.0 112.448 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.0 pttt 44.54 38.94 2.92 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.42 1.888 . . . . 0.0 112.029 -168.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.16 163.77 9.66 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.784 0.802 . . . . 0.0 111.169 177.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 m -55.95 123.94 16.01 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.515 2.326 . . . . 0.0 110.397 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.27 -42.51 52.35 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.288 1.435 . . . . 0.0 113.016 -172.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -70.7 -32.8 70.16 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.708 -0.663 . . . . 0.0 111.799 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.79 -51.46 68.22 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.519 1.054 . . . . 0.0 109.519 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.7 mp -46.51 -54.29 2.25 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 C-N-CA 124.579 1.152 . . . . 0.0 109.865 170.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.14 -29.32 62.79 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -169.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.71 -40.24 76.41 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 123.424 0.69 . . . . 0.0 109.637 172.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -66.9 -29.78 69.76 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.587 1.155 . . . . 0.0 111.408 173.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.2 t -66.82 -44.33 89.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.989 1.316 . . . . 0.0 109.847 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -43.02 99.84 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 121.624 -0.673 . . . . 0.0 109.36 176.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -61.12 -43.3 99.09 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.282 -0.887 . . . . 0.0 112.435 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.88 -44.76 70.71 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.863 1.665 . . . . 0.0 110.0 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -63.86 -49.57 72.25 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.466 174.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -55.44 -49.3 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.087 1.312 . . . . 0.0 110.066 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.42 -46.7 89.03 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.162 0.585 . . . . 0.0 111.072 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -57.69 -36.67 72.27 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.903 0.774 . . . . 0.0 111.217 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -10.12 59.24 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.268 0.627 . . . . 0.0 112.374 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -79.19 -51.48 9.44 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.013 1.279 . . . . 0.0 109.116 165.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.29 -42.53 95.67 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.536 0.734 . . . . 0.0 112.416 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.42 112.51 4.18 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 126.82 2.152 . . . . 0.0 111.247 -171.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.31 -4.4 14.22 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.167 2.578 . . . . 0.0 113.152 -176.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -126.87 95.06 4.21 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.7 1.2 . . . . 0.0 109.186 -174.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.09 75.08 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 108.943 -171.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.7 t -125.63 75.58 1.5 Allowed 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.99 -1.069 . . . . 0.0 109.544 -173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mtpt -71.51 77.13 0.79 Allowed 'General case' 0 C--O 1.238 0.483 0 C-N-CA 123.177 0.591 . . . . 0.0 110.174 168.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 64.48 -79.92 0.03 OUTLIER 'General case' 0 C--O 1.234 0.263 0 C-N-CA 128.63 2.772 . . . . 0.0 112.102 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -138.59 136.92 36.49 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.214 0.916 . . . . 0.0 110.342 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 129.88 15.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.633 2.773 . . . . 0.0 106.593 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -161.85 80.63 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -155.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 tt -133.51 -45.77 0.82 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 117.506 -1.235 . . . . 0.0 112.333 -163.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.7 mttm 49.69 82.37 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.064 1.746 . . . . 0.0 112.107 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.5 t -117.67 135.38 23.28 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 123.406 0.682 . . . . 0.0 111.606 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -80.03 167.26 20.18 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 124.432 3.421 . . . . 0.0 112.0 174.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -140.09 153.42 46.73 Favored 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 124.584 1.154 . . . . 0.0 109.854 -175.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 m -144.48 170.03 16.82 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 106.981 -1.488 . . . . 0.0 106.981 151.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -68.89 -175.58 11.11 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.51 1.529 . . . . 0.0 113.059 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -80.56 35.09 0.56 Allowed 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 124.368 3.379 . . . . 0.0 112.248 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.8 m 65.85 120.81 0.02 OUTLIER 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.838 1.655 . . . . 0.0 109.689 -149.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 69.58 102.48 0.06 Allowed 'General case' 0 C--O 1.236 0.374 0 C-N-CA 126.278 1.831 . . . . 0.0 110.318 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 173.916 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 110.38 -1.088 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.2 m -124.97 90.92 3.33 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.286 1.434 . . . . 0.0 108.185 -178.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.3 p -63.6 159.15 19.49 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.623 1.169 . . . . 0.0 110.808 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.22 39.94 95.18 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 123.651 0.643 . . . . 0.0 112.422 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 t -121.96 85.6 2.44 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 105.809 -1.922 . . . . 0.0 105.809 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.6 p 50.71 177.68 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.487 2.715 . . . . 0.0 113.439 -156.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.22 161.51 19.69 Favored Glycine 0 C--O 1.24 0.512 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 170.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.6 ttm -93.77 -28.45 15.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.35 1.06 . . . . 0.0 111.451 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.68 87.75 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 118.567 0.622 . . . . 0.0 109.584 173.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -57.35 -43.89 83.87 Favored 'General case' 0 C--O 1.23 0.067 0 C-N-CA 125.073 1.349 . . . . 0.0 110.063 172.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -57.63 -48.97 77.97 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-O 118.352 -0.832 . . . . 0.0 109.098 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.8 -27.85 66.94 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.224 0.92 . . . . 0.0 113.282 -178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.09 -44.13 27.07 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.964 0.802 . . . . 0.0 110.979 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HB3' HD21 ' A' ' 52' ' ' LEU . 10.6 mt -63.67 -41.05 98.23 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.123 0.569 . . . . 0.0 111.071 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.58 -31.93 72.0 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 126.099 1.76 . . . . 0.0 109.864 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.85 -46.1 86.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.558 0.743 . . . . 0.0 110.022 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.29 -41.13 98.94 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 118.886 -0.578 . . . . 0.0 110.263 177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.9 t -55.97 -52.71 46.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 118.762 0.71 . . . . 0.0 109.575 174.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -55.49 -59.48 4.77 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 117.229 -1.367 . . . . 0.0 109.6 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.61 -42.29 82.98 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 125.258 1.423 . . . . 0.0 111.914 -175.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -61.11 -50.35 73.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.266 0.939 . . . . 0.0 109.734 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.05 -46.01 94.39 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -45.06 79.15 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.444 1.498 . . . . 0.0 110.307 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -70.07 -46.88 64.0 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.408 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -59.92 -38.49 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 119.321 0.964 . . . . 0.0 110.278 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.5 mmt85 -57.27 -37.9 73.07 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.224 0.92 . . . . 0.0 110.408 172.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.12 -44.5 35.44 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -66.12 -37.17 85.07 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.787 1.793 . . . . 0.0 110.611 -172.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -59.2 -51.78 68.51 Favored 'General case' 0 C--O 1.231 0.119 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 172.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -58.85 -36.69 74.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.104 1.361 . . . . 0.0 111.924 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.17 -13.14 60.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.768 1.167 . . . . 0.0 111.559 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 8.8 mmpt? 51.32 51.42 16.9 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.91 1.684 . . . . 0.0 111.009 -165.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.76 168.46 1.72 Allowed 'General case' 0 C--O 1.242 0.682 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.33 169.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -51.74 134.15 30.76 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.564 0.746 . . . . 0.0 109.31 168.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.36 67.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.633 0.773 . . . . 0.0 111.317 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.74 -49.31 71.31 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.086 0.955 . . . . 0.0 109.92 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.3 tp -59.88 -47.06 87.29 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.514 1.126 . . . . 0.0 109.679 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mt -57.67 -47.19 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 117.985 -1.007 . . . . 0.0 108.854 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.26 -37.85 88.88 Favored 'General case' 0 N--CA 1.457 -0.123 0 CA-C-N 119.661 1.119 . . . . 0.0 112.761 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.82 -45.34 92.66 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.095 0.958 . . . . 0.0 109.279 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.25 -27.59 42.36 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 125.694 1.597 . . . . 0.0 111.191 -173.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.5 t -71.16 -46.54 65.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 126.415 1.886 . . . . 0.0 108.326 170.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.38 -41.12 84.1 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 121.161 -0.962 . . . . 0.0 110.281 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.456 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 42.0 mttp -60.44 -52.81 63.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.243 0.928 . . . . 0.0 111.488 168.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.7 tp -53.01 -35.74 59.73 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.12 1.368 . . . . 0.0 111.039 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.53 -64.59 0.83 Allowed 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.649 1.58 . . . . 0.0 109.715 177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 25.9 pttt -67.47 -25.53 65.93 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.89 -60.66 3.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 O-C-N 120.95 -1.094 . . . . 0.0 108.64 168.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -53.64 -38.8 64.45 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.12 0.873 . . . . 0.0 111.23 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.11 70.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.86 -0.591 . . . . 0.0 112.563 -175.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -73.17 -51.13 18.99 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.299 0.954 . . . . 0.0 111.238 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 14' ' ' LEU . 4.2 mm? -67.48 -22.48 65.46 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 123.076 0.55 . . . . 0.0 111.954 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -151.16 77.35 0.23 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.594 1.569 . . . . 0.0 110.022 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -78.24 49.56 3.06 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 124.652 3.568 . . . . 0.0 110.605 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 69.27 145.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 128.322 2.649 . . . . 0.0 111.843 -171.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 42.46 92.02 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 129.374 3.07 . . . . 0.0 114.641 -168.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.76 12.71 29.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.547 -1.346 . . . . 0.0 113.056 -172.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -151.99 130.11 11.91 Favored 'General case' 0 C--O 1.233 0.222 0 O-C-N 120.656 -1.277 . . . . 0.0 109.364 176.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 45.04 -172.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 111.223 -152.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 mmtm 57.23 26.96 12.89 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.974 -1.079 . . . . 0.0 112.972 170.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -76.79 77.14 3.41 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.16 55.76 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.221 0 C-N-CA 126.066 1.746 . . . . 0.0 107.933 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 46.4 tp -123.82 118.62 27.56 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 126.642 1.977 . . . . 0.0 106.425 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 35.42 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 128.947 2.899 . . . . 0.0 112.422 173.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.7 123.08 9.26 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 126.068 1.747 . . . . 0.0 110.61 -172.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.7 -41.26 32.05 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.08 1.853 . . . . 0.0 113.249 -172.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -156.14 -178.77 7.56 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.234 0.925 . . . . 0.0 109.649 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -144.88 165.41 28.21 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.631 1.572 . . . . 0.0 107.895 168.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 133.47 -170.43 22.32 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -168.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -69.37 157.7 60.17 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 121.734 1.623 . . . . 0.0 110.138 171.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -169.39 173.88 6.32 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.793 2.037 . . . . 0.0 108.008 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m 53.18 -150.79 0.35 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.52 0.728 . . . . 0.0 111.325 173.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.241 0 N-CA-C 106.524 -2.63 . . . . 0.0 106.524 -151.766 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.856 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -117.39 -31.9 5.12 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.023 0.929 . . . . 0.0 109.668 163.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.7 p -153.55 179.56 8.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.602 1.561 . . . . 0.0 108.7 167.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.73 -179.35 47.84 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 168.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.6 m 51.2 60.11 4.11 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.657 1.183 . . . . 0.0 112.693 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.0 m -59.01 102.57 0.13 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 164.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -163.91 150.84 19.77 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 126.012 1.768 . . . . 0.0 109.573 -168.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.37 -43.86 96.44 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 118.152 -0.927 . . . . 0.0 112.764 -163.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.2 -47.16 74.81 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.316 0.962 . . . . 0.0 110.092 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.65 -42.59 98.09 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.048 -0.408 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -60.76 -43.39 98.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 118.406 -0.807 . . . . 0.0 111.184 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.19 72.21 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.009 1.277 . . . . 0.0 110.95 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.67 -39.07 84.54 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 122.705 0.402 . . . . 0.0 111.851 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.15 -35.64 64.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.19 0.904 . . . . 0.0 110.76 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -59.56 -35.25 73.89 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.857 1.663 . . . . 0.0 109.6 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.25 -46.32 89.35 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 118.969 0.804 . . . . 0.0 109.749 173.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.53 -39.19 90.16 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.21 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 96.6 t -66.04 -47.8 83.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 119.621 1.1 . . . . 0.0 110.889 176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.92 -58.53 7.23 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.808 0.843 . . . . 0.0 109.421 176.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -41.65 90.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.241 1.416 . . . . 0.0 110.497 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -60.7 -53.04 62.19 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.065 0.848 . . . . 0.0 110.714 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.42 73.92 Favored Glycine 0 CA--C 1.524 0.61 0 O-C-N 121.864 -0.523 . . . . 0.0 112.321 -176.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -64.63 -52.92 54.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 117.968 0.884 . . . . 0.0 110.208 167.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -56.62 -44.85 81.61 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 118.647 0.658 . . . . 0.0 111.172 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 26.4 t -48.28 -48.33 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 123.715 0.806 . . . . 0.0 111.054 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -65.91 -45.11 83.15 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.25 0.932 . . . . 0.0 110.636 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -56.14 -40.63 84.06 Favored Glycine 0 CA--C 1.524 0.624 0 CA-C-O 119.167 -0.796 . . . . 0.0 111.824 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.61 -43.23 73.18 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.669 1.235 . . . . 0.0 110.682 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -56.88 -40.42 76.16 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.82 0.848 . . . . 0.0 111.205 173.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -68.89 -41.86 77.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.599 1.159 . . . . 0.0 111.136 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -67.23 -5.79 15.42 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.084 2.154 . . . . 0.0 111.959 175.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 47.61 41.8 14.01 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.275 1.43 . . . . 0.0 111.432 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.28 171.93 0.15 Allowed 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.945 0.403 . . . . 0.0 111.291 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.5 m -52.6 146.59 9.81 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.602 0.761 . . . . 0.0 110.085 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.54 -48.12 77.96 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 170.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.29 -42.86 70.55 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.738 1.615 . . . . 0.0 111.575 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.4 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.4 tp -68.65 -52.13 34.63 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 118.599 0.636 . . . . 0.0 109.781 -173.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.0 mt -58.18 -48.09 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 125.511 1.525 . . . . 0.0 109.586 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.23 -49.04 75.26 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 124.977 1.311 . . . . 0.0 110.596 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -66.05 -36.59 83.64 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.48 -34.08 76.43 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.158 -0.964 . . . . 0.0 111.074 175.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.95 -39.33 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.723 1.209 . . . . 0.0 109.704 170.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -36.93 84.94 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 120.69 -1.256 . . . . 0.0 110.18 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 mtpp -67.2 -45.65 76.26 Favored 'General case' 0 C--O 1.226 -0.18 0 C-N-CA 124.667 1.187 . . . . 0.0 109.973 171.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.0 tp -56.35 -47.71 78.28 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.448 1.022 . . . . 0.0 110.135 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.1 mt -54.3 -61.75 2.1 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.087 1.355 . . . . 0.0 110.267 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -66.05 -26.03 67.32 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -171.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.8 mt -67.81 -50.51 56.48 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 124.977 1.311 . . . . 0.0 110.462 169.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -58.9 -31.94 69.07 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.782 1.173 . . . . 0.0 111.1 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -20.03 65.74 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.725 -0.655 . . . . 0.0 112.72 174.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -77.28 -41.22 41.69 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.664 1.12 . . . . 0.0 110.974 171.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.81 -65.84 0.61 Allowed 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 123.977 0.911 . . . . 0.0 110.77 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -58.61 105.48 0.67 Allowed Glycine 0 CA--C 1.525 0.707 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.68 -166.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -65.17 122.22 9.91 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.629 2.219 . . . . 0.0 108.2 -171.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -167.68 -62.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 118.4 -0.809 . . . . 0.0 111.057 -163.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 30.3 78.69 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.982 2.113 . . . . 0.0 112.672 -167.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 87.7 p -123.43 89.3 3.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 171.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -158.09 -176.25 5.81 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.85 0.86 . . . . 0.0 109.599 175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -82.38 144.14 30.74 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.252 0.549 . . . . 0.0 110.344 -174.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -67.75 103.52 1.44 Allowed 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.653 1.981 . . . . 0.0 108.137 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -155.52 82.92 1.04 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.712 0.768 . . . . 0.0 109.932 -175.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.2 p -147.66 144.08 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 121.01 -1.056 . . . . 0.0 109.052 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 tp -143.72 58.57 1.37 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.232 1.013 . . . . 0.0 109.358 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.266 18.9 pttp 43.37 66.63 0.77 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.945 2.098 . . . . 0.0 113.161 -166.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.66 156.81 42.0 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 123.639 0.776 . . . . 0.0 112.139 175.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.43 156.47 45.57 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.022 2.481 . . . . 0.0 109.795 169.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -121.96 48.55 1.7 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.449 1.9 . . . . 0.0 108.308 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 61.0 p -47.29 118.03 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.087 1.755 . . . . 0.0 111.014 174.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -121.45 -178.99 15.96 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.039 0.828 . . . . 0.0 112.429 -163.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.18 160.0 40.46 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.502 2.134 . . . . 0.0 110.285 172.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.9 m 40.33 49.78 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.05 2.14 . . . . 0.0 111.377 171.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -100.62 85.32 2.9 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.309 1.444 . . . . 0.0 107.875 -165.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 -175.82 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -142.45 158.24 43.9 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.924 1.29 . . . . 0.0 108.529 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.6 t 48.22 -159.19 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.833 1.653 . . . . 0.0 110.682 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.46 170.1 42.47 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 120.347 -1.47 . . . . 0.0 112.085 173.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.9 t -77.12 113.43 14.84 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.7 p -145.6 72.98 1.33 Allowed 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.29 163.14 28.81 Favored Glycine 0 CA--C 1.524 0.639 0 C-N-CA 124.62 1.105 . . . . 0.0 112.026 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -57.54 -42.51 83.06 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.291 1.436 . . . . 0.0 110.513 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.5 -58.67 7.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.269 0.627 . . . . 0.0 110.488 -176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -65.14 -28.0 69.12 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.183 -0.323 . . . . 0.0 111.835 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.7 ttp180 -64.91 -50.11 67.79 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.736 -1.126 . . . . 0.0 109.141 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.4 76.38 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.188 0.904 . . . . 0.0 112.16 -173.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.24 80.87 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.724 0.693 . . . . 0.0 111.118 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.87 -28.26 63.41 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.369 -0.832 . . . . 0.0 111.025 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.31 -41.17 96.96 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.327 1.051 . . . . 0.0 108.862 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.74 -46.89 86.4 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 119.283 0.947 . . . . 0.0 108.969 173.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.1 mt -55.87 -53.43 56.91 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 118.785 0.72 . . . . 0.0 109.615 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.3 -56.64 10.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.458 1.103 . . . . 0.0 110.892 178.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.85 -49.27 78.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.584 1.554 . . . . 0.0 110.047 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.62 -39.41 77.22 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.411 1.084 . . . . 0.0 109.955 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.9 tp60 -57.94 -51.06 71.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.87 -43.78 98.42 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.442 1.02 . . . . 0.0 112.692 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.76 -47.22 86.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.694 -0.886 . . . . 0.0 109.567 175.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ttt-85 -64.06 -46.18 85.49 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.713 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 21' ' ' GLN . 24.2 t -48.1 -51.01 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 124.602 1.161 . . . . 0.0 110.139 172.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.82 -44.16 97.27 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.646 -0.659 . . . . 0.0 110.144 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.1 95.82 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 123.95 0.786 . . . . 0.0 112.35 176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.13 -37.96 89.35 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 119.387 1.594 . . . . 0.0 109.215 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -62.49 -46.24 89.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.892 -1.051 . . . . 0.0 110.349 173.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.11 -47.07 75.5 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 120.284 1.402 . . . . 0.0 109.809 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.63 -3.12 22.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.387 1.075 . . . . 0.0 111.032 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 75.9 mttt 50.81 49.77 20.37 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.517 1.527 . . . . 0.0 109.305 -173.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.21 173.34 2.54 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.643 0.735 . . . . 0.0 110.014 175.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -50.13 121.87 6.05 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.129 1.772 . . . . 0.0 108.898 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.29 -29.61 69.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.813 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -69.08 -50.28 49.75 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 117.804 -1.093 . . . . 0.0 109.742 172.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -42.64 68.51 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 119.492 1.042 . . . . 0.0 109.965 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.1 mt -52.59 -50.04 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.47 175.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -74.15 -31.62 62.79 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.725 1.21 . . . . 0.0 112.745 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.2 -49.8 76.46 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 170.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.89 -25.67 62.89 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.755 0.822 . . . . 0.0 111.564 -174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -73.22 -46.06 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.915 1.286 . . . . 0.0 110.269 171.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.73 92.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.15 0.886 . . . . 0.0 110.196 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.7 mtpt -60.11 -44.18 95.06 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.786 0.834 . . . . 0.0 110.635 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 tp -55.97 -47.07 78.31 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.901 0.88 . . . . 0.0 111.119 172.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.37 -55.11 23.28 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.038 0.535 . . . . 0.0 110.012 -174.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 38.2 pttt -63.96 -30.71 71.77 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.897 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.7 mt -57.31 -57.74 11.32 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 119.131 0.878 . . . . 0.0 109.246 170.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -54.77 -39.18 68.11 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 123.668 0.787 . . . . 0.0 111.344 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 -29.62 64.96 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.64 -32.75 70.18 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.296 -0.877 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.69 -15.2 51.38 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.026 1.33 . . . . 0.0 112.183 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.93 81.12 0.55 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 -165.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.96 -28.17 6.32 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.428 2.085 . . . . 0.0 111.583 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -163.4 -63.18 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 126.208 1.803 . . . . 0.0 107.033 176.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.86 148.72 39.96 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.168 0.987 . . . . 0.0 109.065 169.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m -121.18 164.4 16.96 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.861 0.865 . . . . 0.0 109.061 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 39.3 68.46 0.36 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.691 1.596 . . . . 0.0 111.048 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -60.37 122.07 13.63 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 168.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -66.3 123.47 20.05 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.232 0.923 . . . . 0.0 108.538 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.66 162.23 35.6 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.739 0.816 . . . . 0.0 110.825 175.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -69.72 130.76 34.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 166.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 mp -71.54 143.51 49.9 Favored 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 pttm 39.08 68.54 0.35 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.258 1.823 . . . . 0.0 113.302 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.9 t -50.73 138.76 22.72 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 123.312 0.645 . . . . 0.0 111.174 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -74.03 -7.52 20.0 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.742 2.295 . . . . 0.0 113.432 -176.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -74.66 91.82 2.39 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.444 1.475 . . . . 0.0 107.57 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.3 m -137.45 110.46 7.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.813 2.045 . . . . 0.0 106.275 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -127.09 75.72 0.41 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 118.54 -1.145 . . . . 0.0 111.077 -175.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.77 -9.34 21.05 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.008 2.472 . . . . 0.0 114.987 -172.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 47.47 -98.57 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.962 1.705 . . . . 0.0 112.585 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -146.22 -39.61 0.22 Allowed 'General case' 0 C--N 1.332 -0.169 0 O-C-N 120.928 -1.107 . . . . 0.0 109.374 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 106.375 -2.69 . . . . 0.0 106.375 166.596 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.388 0 N-CA-C 108.421 -1.872 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -150.64 176.73 10.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.545 0.738 . . . . 0.0 109.26 161.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 t -128.73 -34.81 1.95 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 126.683 1.993 . . . . 0.0 110.435 -174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.74 -89.76 0.16 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.034 -2.027 . . . . 0.0 108.034 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -165.36 -79.79 0.03 OUTLIER 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 99.13 76.36 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 129.641 3.177 . . . . 0.0 111.606 172.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -162.44 171.15 38.23 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 109.836 -1.306 . . . . 0.0 109.836 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ttt -89.46 -46.74 8.48 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 168.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.3 -48.22 81.19 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.46 -10.5 59.86 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.671 0.789 . . . . 0.0 111.93 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.3 ttt180 -81.53 -48.73 11.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 119.786 1.175 . . . . 0.0 109.111 164.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.54 -41.29 66.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.615 -0.707 . . . . 0.0 111.23 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.95 -46.54 84.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.069 0.947 . . . . 0.0 112.296 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -36.79 75.66 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.479 -0.763 . . . . 0.0 109.702 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -61.62 -32.89 73.04 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.572 1.149 . . . . 0.0 110.38 170.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.52 -48.01 76.72 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.179 0.899 . . . . 0.0 109.676 175.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.99 -42.1 93.46 Favored 'General case' 0 C--N 1.339 0.12 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 75.1 t -60.29 -55.66 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.375 174.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -54.46 -56.94 13.63 Favored 'General case' 0 CA--C 1.511 -0.537 0 C-N-CA 124.789 1.236 . . . . 0.0 111.075 -177.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -35.3 72.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.826 0.85 . . . . 0.0 110.485 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -67.29 -48.16 68.47 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 119.877 1.217 . . . . 0.0 110.774 174.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.99 -41.4 84.71 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.556 1.074 . . . . 0.0 111.851 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -50.34 65.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.577 1.151 . . . . 0.0 108.658 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.3 ttt85 -64.91 -46.35 82.08 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.668 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -52.97 -47.48 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.051 1.34 . . . . 0.0 110.466 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.8 mtt180 -58.07 -47.15 84.05 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.394 -0.816 . . . . 0.0 110.418 174.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -61.14 -38.31 95.38 Favored Glycine 0 CA--C 1.532 1.137 0 N-CA-C 112.15 -0.38 . . . . 0.0 112.15 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.53 -37.54 85.23 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 120.42 -1.635 . . . . 0.0 111.616 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -63.67 -41.69 98.14 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 118.989 0.813 . . . . 0.0 110.661 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -53.74 -51.68 62.57 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.742 0.817 . . . . 0.0 109.394 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.39 1.52 3.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.955 1.702 . . . . 0.0 112.632 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? 39.44 51.36 2.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.964 2.105 . . . . 0.0 111.301 -170.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.14 163.8 3.47 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.547 169.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 71.6 m -55.24 139.32 42.74 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 171.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.96 -45.33 60.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.939 0.896 . . . . 0.0 110.266 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.88 -19.2 63.43 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.383 0.673 . . . . 0.0 112.701 -171.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.71 -56.12 4.99 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 167.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 mt -52.45 -49.22 44.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 124.445 1.098 . . . . 0.0 109.942 -176.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -70.21 -25.34 63.37 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 126.107 1.763 . . . . 0.0 112.526 -174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -42.31 57.61 Favored 'General case' 0 N--CA 1.457 -0.125 0 O-C-N 120.902 -1.124 . . . . 0.0 109.658 169.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.51 -32.0 73.09 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 121.668 -0.645 . . . . 0.0 110.17 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.88 -49.49 76.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 126.695 1.998 . . . . 0.0 110.099 168.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -53.48 -47.77 69.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.821 0.737 . . . . 0.0 109.854 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt -60.24 -47.98 83.67 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 124.928 1.291 . . . . 0.0 111.975 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.558 HD11 ' HE3' ' A' ' 49' ' ' LYS . 35.5 tp -52.92 -44.08 66.72 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.207 1.003 . . . . 0.0 109.914 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 mt -66.75 -55.46 14.91 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.911 1.285 . . . . 0.0 111.488 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -22.96 64.23 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.819 0.736 . . . . 0.0 112.843 -178.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.64 -56.72 13.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 119.521 1.055 . . . . 0.0 109.442 165.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.558 ' HE3' HD11 ' A' ' 45' ' ' LEU . 88.2 mttt -56.61 -31.77 64.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.474 0.579 . . . . 0.0 112.519 -177.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.37 -27.12 63.92 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.33 -40.19 37.29 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.254 1.022 . . . . 0.0 111.598 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.09 -56.72 18.61 Favored 'General case' 0 C--N 1.334 -0.073 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 171.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.58 170.55 11.88 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 124.49 1.043 . . . . 0.0 111.07 178.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 30.89 0.26 Allowed 'Trans proline' 0 CA--C 1.543 0.936 1 C-N-CA 126.359 4.706 . . . . 0.0 112.344 174.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -51.69 -63.36 1.16 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.889 2.076 . . . . 0.0 110.653 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -145.13 92.45 2.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.1 t -150.54 -31.84 0.18 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.702 0.801 . . . . 0.0 112.576 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.1 tttp 60.26 -5.84 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.895 2.478 . . . . 0.0 115.091 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -110.53 109.27 19.54 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 120.941 -1.099 . . . . 0.0 108.247 -158.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -163.04 77.74 0.44 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.497 1.119 . . . . 0.0 108.581 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -101.58 85.37 2.74 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.544 -0.723 . . . . 0.0 110.098 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.95 126.1 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.33 108.49 4.81 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -134.6 149.32 50.58 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.852 2.061 . . . . 0.0 107.439 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 4.2 t -57.09 143.47 72.17 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 166.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.97 67.89 5.83 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.655 2.904 . . . . 0.0 110.782 -175.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -147.76 132.3 17.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 126.816 2.047 . . . . 0.0 107.916 177.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 60.0 m -161.32 137.81 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 125.894 1.678 . . . . 0.0 107.707 170.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 127.31 -174.48 18.38 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 118.466 0.576 . . . . 0.0 113.962 171.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.21 170.11 21.06 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 124.245 3.297 . . . . 0.0 110.985 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 54.5 p -139.18 145.16 38.99 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 164.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.34 -35.32 0.25 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.711 2.004 . . . . 0.0 114.935 -175.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 107.815 -2.114 . . . . 0.0 107.815 -176.936 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.963 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 48.62 31.62 3.06 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.711 1.605 . . . . 0.0 114.044 165.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.32 128.69 36.27 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 144.23 -159.49 27.7 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -166.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -159.61 172.99 16.8 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.29 1.036 . . . . 0.0 109.513 169.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 m 55.48 64.23 1.83 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.909 1.284 . . . . 0.0 111.086 166.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.37 163.93 34.2 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.484 -1.046 . . . . 0.0 110.484 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.9 mtt -67.82 -50.6 55.88 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -44.77 90.09 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.26 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -56.73 -58.89 6.16 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.769 0.713 . . . . 0.0 109.892 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 31.7 ttt85 -65.62 -29.82 70.45 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.455 -0.778 . . . . 0.0 110.346 -175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -35.93 82.32 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 119.753 1.16 . . . . 0.0 111.705 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.4 -41.83 98.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.222 0.609 . . . . 0.0 110.099 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 mt -69.9 -42.13 73.8 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.172 0.989 . . . . 0.0 110.291 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -62.61 -33.25 74.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.092 1.357 . . . . 0.0 111.255 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -62.0 -51.85 66.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 118.108 -0.948 . . . . 0.0 109.358 173.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 91.3 mt -54.64 -46.21 73.91 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.652 0.595 . . . . 0.0 109.847 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.2 t -63.33 -47.35 92.41 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 O-C-N 121.347 -0.846 . . . . 0.0 111.283 178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.499 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 8.5 ttpt -61.61 -55.36 31.52 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.133 -177.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -55.67 -49.08 73.87 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 126.009 1.724 . . . . 0.0 110.671 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -60.53 -39.04 86.38 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 118.868 0.758 . . . . 0.0 110.889 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.56 -51.8 51.31 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 121.616 -0.678 . . . . 0.0 112.345 175.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -45.0 75.77 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.649 1.58 . . . . 0.0 108.501 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.0 ttt85 -64.71 -52.59 56.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 117.203 -1.379 . . . . 0.0 109.288 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.3 t -53.81 -41.76 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 120.655 1.57 . . . . 0.0 111.665 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.8 -50.02 75.46 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.346 0.975 . . . . 0.0 109.22 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -48.77 -47.73 30.49 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 124.377 0.989 . . . . 0.0 112.258 172.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.8 mt -64.24 -45.67 87.16 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.838 1.819 . . . . 0.0 110.89 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -64.12 -32.66 74.31 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.679 -0.638 . . . . 0.0 110.217 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -65.38 -47.64 75.68 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.261 -0.899 . . . . 0.0 110.653 168.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -73.02 -10.3 59.66 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.919 1.688 . . . . 0.0 112.234 -169.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt 52.16 56.33 7.9 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.438 1.895 . . . . 0.0 109.736 -170.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -68.01 175.91 2.89 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 114.306 -1.316 . . . . 0.0 110.15 170.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 1.1 m -48.11 129.45 15.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.183 0.993 . . . . 0.0 108.328 167.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.72 72.9 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 122.838 0.455 . . . . 0.0 110.324 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -64.23 -46.4 83.97 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 124.752 1.221 . . . . 0.0 111.683 171.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.406 ' H ' ' HB2' ' A' ' 34' ' ' SER . 16.5 tp -54.3 -47.17 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 22.4 mt -57.82 -49.53 80.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -45.25 89.78 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.648 1.179 . . . . 0.0 113.048 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.01 -39.04 86.97 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 126.069 1.748 . . . . 0.0 110.828 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -70.58 -39.47 73.84 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.362 1.065 . . . . 0.0 109.282 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -63.42 -42.79 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.113 0 C-N-CA 125.429 1.492 . . . . 0.0 110.43 172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.46 -44.09 97.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 119.162 0.892 . . . . 0.0 109.583 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -66.34 -40.84 90.11 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.816 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.0 tp -57.34 -48.02 80.09 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 120.015 1.28 . . . . 0.0 110.747 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -55.48 -56.96 14.14 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.786 1.234 . . . . 0.0 109.698 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.97 -19.13 55.1 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.56 -52.49 65.33 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 120.448 1.476 . . . . 0.0 108.271 165.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.5 mtpt -59.46 -27.94 66.54 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 118.556 -0.735 . . . . 0.0 112.012 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.12 -21.4 66.79 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.54 1.064 . . . . 0.0 112.78 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -75.04 -41.52 58.96 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.174 1.352 . . . . 0.0 110.872 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.84 -56.39 15.79 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-O 117.514 -1.231 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -53.32 93.68 0.01 OUTLIER Glycine 0 C--N 1.34 0.79 0 C-N-CA 127.31 2.385 . . . . 0.0 110.903 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -77.03 -28.74 5.73 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 CA-C-N 118.61 1.205 . . . . 0.0 112.07 -146.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.1 t0 175.68 121.79 0.03 OUTLIER 'General case' 0 C--O 1.232 0.146 0 C-N-CA 129.112 2.965 . . . . 0.0 105.798 157.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -139.89 -64.89 0.47 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.417 0.553 . . . . 0.0 110.575 -168.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.252 88.6 p 44.72 -166.23 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.756 2.022 . . . . 0.0 113.4 -169.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.5 pttm -169.35 161.68 10.05 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.208 1.803 . . . . 0.0 109.084 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 59.18 -85.6 0.02 OUTLIER 'General case' 0 C--O 1.237 0.404 0 C-N-CA 127.524 2.33 . . . . 0.0 111.883 176.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -61.08 152.32 28.57 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 119.708 1.14 . . . . 0.0 108.207 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -114.37 136.67 52.73 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 125.867 1.667 . . . . 0.0 108.069 -168.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.259 34.0 m 42.73 44.88 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 127.159 2.183 . . . . 0.0 112.839 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 20.4 tp -72.74 76.2 1.12 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.072 1.349 . . . . 0.0 109.376 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 ptpp? -65.52 142.58 58.07 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 126.79 2.036 . . . . 0.0 110.612 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.5 p -109.63 153.07 43.12 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 123.977 0.911 . . . . 0.0 111.268 -158.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -76.22 116.29 4.32 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 113.42 -173.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -73.68 48.5 0.28 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.312 2.245 . . . . 0.0 113.422 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -43.94 97.55 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.777 -1.202 . . . . 0.0 110.959 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.17 96.66 1.6 Allowed Glycine 0 CA--C 1.528 0.847 0 CA-C-O 117.689 -1.617 . . . . 0.0 110.876 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.04 125.03 13.45 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 CA-C-N 120.926 2.363 . . . . 0.0 108.217 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.9 t -160.56 142.9 12.85 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.3 1.44 . . . . 0.0 108.24 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.32 -98.17 0.03 OUTLIER 'General case' 0 C--O 1.238 0.458 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 173.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 N-CA-C 109.294 -1.523 . . . . 0.0 109.294 171.666 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.855 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -31.55 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.561 0.744 . . . . 0.0 111.247 170.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -149.43 -177.94 6.14 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.093 1.357 . . . . 0.0 108.633 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.18 13.01 0.03 OUTLIER Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.392 1.949 . . . . 0.0 112.473 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 p -160.48 147.54 15.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 119.962 1.881 . . . . 0.0 109.749 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.0 m -145.48 62.21 1.28 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.881 0.872 . . . . 0.0 111.211 169.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.69 172.98 40.21 Favored Glycine 0 C--N 1.335 0.481 0 O-C-N 120.777 -1.202 . . . . 0.0 111.598 172.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.0 tmm? -66.72 -51.57 54.42 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 117.366 0.583 . . . . 0.0 109.981 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.22 -46.37 89.19 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.258 0.623 . . . . 0.0 111.193 -176.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -56.0 -53.29 58.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 123.154 0.582 . . . . 0.0 109.746 173.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -53.2 -49.77 66.05 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 116.67 -1.634 . . . . 0.0 108.963 177.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.35 70.66 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 121.388 1.904 . . . . 0.0 112.255 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.56 74.9 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.493 0.717 . . . . 0.0 112.043 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.3 mp -77.85 -32.64 52.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.214 -0.929 . . . . 0.0 111.276 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -65.92 -37.9 87.26 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.142 1.777 . . . . 0.0 108.738 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -53.15 -47.13 68.98 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.305 0.642 . . . . 0.0 109.806 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.9 mt -66.17 -44.59 83.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 119.362 -0.351 . . . . 0.0 110.214 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -60.19 -46.33 94.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-N 119.293 0.951 . . . . 0.0 110.284 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -56.36 -64.22 0.93 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.541 1.536 . . . . 0.0 109.578 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.6 -36.49 74.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.032 0.933 . . . . 0.0 110.979 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -65.19 -45.03 86.48 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 119.343 0.974 . . . . 0.0 111.527 176.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.41 -37.94 58.48 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.181 0.901 . . . . 0.0 112.794 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -58.77 -52.43 65.75 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 125.558 1.543 . . . . 0.0 108.975 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -57.82 -41.59 82.57 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.417 -1.277 . . . . 0.0 111.02 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -58.98 -44.27 90.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 120.438 1.472 . . . . 0.0 111.188 175.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -57.68 -41.83 82.41 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 120.01 1.277 . . . . 0.0 109.806 173.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.81 98.04 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 123.898 0.761 . . . . 0.0 112.553 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.52 -40.01 92.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.742 1.771 . . . . 0.0 110.741 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.2 mttt -63.91 -45.64 88.42 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.741 0.417 . . . . 0.0 109.915 177.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.1 tt0 -59.3 -43.94 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.648 1.179 . . . . 0.0 111.25 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -66.89 -14.23 62.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.275 1.43 . . . . 0.0 111.381 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? 48.38 54.09 10.93 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.414 1.485 . . . . 0.0 110.123 -168.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.52 172.21 0.71 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.14 0.972 . . . . 0.0 110.792 161.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.5 m -56.89 142.96 39.41 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.265 1.826 . . . . 0.0 110.385 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.91 79.53 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.669 179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -55.89 -54.26 46.79 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.928 1.291 . . . . 0.0 109.86 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.2 tp -55.92 -47.93 76.61 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.729 0.812 . . . . 0.0 109.696 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.12 -46.4 96.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.39 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.26 -44.89 92.4 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.981 1.264 . . . . 0.0 110.458 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -60.12 -53.39 58.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 125.864 1.665 . . . . 0.0 109.263 179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -64.23 -29.4 70.5 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.812 0.845 . . . . 0.0 111.393 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.71 -44.47 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.065 1.346 . . . . 0.0 110.186 172.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.61 95.27 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 120.782 -1.199 . . . . 0.0 110.56 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -70.88 -31.09 67.64 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 125.785 1.634 . . . . 0.0 111.427 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.5 tp -68.27 -46.66 69.8 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.959 1.304 . . . . 0.0 110.422 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.3 mt -56.91 -49.57 75.18 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.294 1.038 . . . . 0.0 108.349 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.8 -44.13 90.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.073 1.349 . . . . 0.0 111.975 177.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.14 -59.27 5.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 119.353 0.978 . . . . 0.0 109.974 175.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -60.83 -32.37 71.76 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.917 0.487 . . . . 0.0 111.752 -175.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.05 -4.48 3.51 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -102.14 -40.55 6.76 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.975 1.71 . . . . 0.0 111.023 172.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.28 -47.77 82.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.359 1.064 . . . . 0.0 110.085 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -98.53 -170.45 31.67 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.095 1.331 . . . . 0.0 111.194 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.4 -69.07 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.327 2.685 . . . . 0.0 112.34 -167.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -163.26 145.69 10.09 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.08 10.44 3.56 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.346 0.976 . . . . 0.0 112.469 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 m -56.25 102.87 0.09 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.373 1.069 . . . . 0.0 111.956 -171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 68.5 tttt -165.67 94.52 0.6 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -101.6 -9.33 21.06 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -174.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -149.9 -174.92 4.85 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.267 1.427 . . . . 0.0 107.196 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -66.71 112.96 4.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 173.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.1 m -137.26 98.42 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 104.917 -2.253 . . . . 0.0 104.917 170.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 52.6 tp -80.25 82.89 6.21 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.488 1.515 . . . . 0.0 107.607 -173.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -146.94 -178.68 6.32 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.701 1.201 . . . . 0.0 110.109 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.1 t -134.75 157.3 77.5 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 126.415 1.886 . . . . 0.0 107.11 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -73.26 125.49 10.29 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.591 2.194 . . . . 0.0 110.839 175.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HE3' ' HA ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -140.43 140.18 35.38 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.484 1.114 . . . . 0.0 108.227 170.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.3 m 59.25 170.9 0.07 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.233 1.813 . . . . 0.0 112.578 -173.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 170.54 176.33 39.87 Favored Glycine 0 CA--C 1.529 0.955 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -71.68 179.05 5.04 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.71 2.273 . . . . 0.0 109.895 164.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -155.24 -74.57 0.11 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.438 -0.789 . . . . 0.0 109.586 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -171.4 2.5 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 128.809 2.844 . . . . 0.0 106.358 175.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 159.018 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 t -79.71 96.22 6.18 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 166.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.2 m -59.34 100.26 0.07 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.885 1.274 . . . . 0.0 109.134 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.8 62.89 0.64 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -167.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.7 t -121.78 173.97 7.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.771 1.228 . . . . 0.0 107.777 174.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.9 m -137.12 42.93 2.39 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.826 1.25 . . . . 0.0 108.934 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.71 130.06 21.83 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 124.385 0.993 . . . . 0.0 110.647 176.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 ttp -66.48 -49.45 66.58 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -174.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.02 -28.64 62.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.968 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -63.01 -51.64 66.04 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.702 0.683 . . . . 0.0 109.272 173.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -53.28 -44.24 68.11 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.382 0.673 . . . . 0.0 110.232 172.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.61 68.28 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.299 0.954 . . . . 0.0 113.562 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.41 -22.94 22.3 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.453 1.101 . . . . 0.0 111.96 177.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 mt -74.93 -41.97 58.62 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.711 1.204 . . . . 0.0 108.351 170.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -58.16 -36.14 72.58 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.116 1.366 . . . . 0.0 110.889 170.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -56.56 -47.5 79.33 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 119.273 0.942 . . . . 0.0 110.448 173.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.3 mt -59.63 -41.8 91.29 Favored 'General case' 0 C--O 1.224 -0.288 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.2 t -67.17 -41.99 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 123.398 0.679 . . . . 0.0 111.698 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.31 -55.68 25.84 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.671 1.588 . . . . 0.0 108.709 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.29 -47.47 84.17 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 125.549 1.54 . . . . 0.0 110.676 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -61.05 -43.77 98.4 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.781 0.719 . . . . 0.0 109.886 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.21 87.28 Favored Glycine 0 CA--C 1.527 0.803 0 O-C-N 121.5 -0.75 . . . . 0.0 111.317 176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -53.39 -52.36 59.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.356 1.062 . . . . 0.0 110.359 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.9 ttt180 -55.43 -51.63 66.25 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 126.083 1.753 . . . . 0.0 111.326 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.66 -48.6 87.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 124.904 1.282 . . . . 0.0 110.005 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -58.14 -42.04 84.98 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 120.957 -1.089 . . . . 0.0 109.268 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.28 91.64 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 124.543 1.068 . . . . 0.0 112.329 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 mt -71.04 -36.38 72.33 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 119.598 1.699 . . . . 0.0 111.009 -176.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 mttm -60.69 -42.02 96.33 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.684 0.675 . . . . 0.0 110.988 169.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -61.67 -40.61 95.57 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.214 1.005 . . . . 0.0 111.538 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -73.07 -2.24 20.55 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.997 1.319 . . . . 0.0 111.552 174.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 41.23 48.17 3.06 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 127.347 2.259 . . . . 0.0 110.679 -172.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.19 174.72 1.91 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.695 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.0 m -60.52 136.85 58.18 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.494 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.64 70.82 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.21 0.604 . . . . 0.0 112.227 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -64.75 -52.68 55.74 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.644 0.778 . . . . 0.0 109.609 177.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.6 tp -53.21 -51.46 62.06 Favored 'General case' 0 C--N 1.338 0.085 0 C-N-CA 123.902 0.881 . . . . 0.0 109.712 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.79 -43.5 88.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.2 -23.77 62.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 120.671 -1.268 . . . . 0.0 112.922 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -65.6 -56.16 13.73 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.659 1.184 . . . . 0.0 108.411 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -31.03 67.44 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.413 -0.803 . . . . 0.0 112.403 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.1 t -67.33 -48.63 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 120.001 1.273 . . . . 0.0 109.789 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.97 79.32 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.756 1.162 . . . . 0.0 110.348 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -65.58 -40.29 92.57 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 112.084 176.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.1 tp -61.55 -48.28 81.71 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 125.626 1.571 . . . . 0.0 109.917 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.81 -56.14 25.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.25 1.42 . . . . 0.0 109.131 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -67.87 -29.22 68.29 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 119.092 -0.48 . . . . 0.0 112.174 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 mt -58.41 -52.51 65.33 Favored 'General case' 0 C--N 1.342 0.26 0 CA-C-N 119.127 0.876 . . . . 0.0 110.006 169.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -58.53 -36.4 73.78 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.936 0.789 . . . . 0.0 111.484 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.19 -21.49 66.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.904 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -78.12 -53.04 7.82 Favored 'General case' 0 C--N 1.342 0.24 0 CA-C-N 119.124 0.874 . . . . 0.0 109.768 167.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.13 -33.51 67.45 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 117.723 -1.132 . . . . 0.0 113.481 -169.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -84.41 104.99 2.77 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.59 1.567 . . . . 0.0 109.399 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -72.29 169.31 21.91 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.68 2.253 . . . . 0.0 110.873 -177.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -49.5 139.52 12.02 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.856 1.262 . . . . 0.0 108.758 159.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -56.05 140.85 42.21 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 167.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.72 2.44 4.16 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.668 -0.645 . . . . 0.0 112.357 177.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -64.37 136.28 56.97 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.733 1.213 . . . . 0.0 109.299 170.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -67.54 99.02 0.72 Allowed 'General case' 0 C--O 1.238 0.475 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 172.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.6 tttm -142.46 74.93 1.47 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -172.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 49.59 56.43 7.86 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.813 1.645 . . . . 0.0 112.393 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -139.77 79.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 O-C-N 121.123 -0.986 . . . . 0.0 110.151 -174.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mp 53.57 -145.96 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.949 1.3 . . . . 0.0 108.485 -172.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -134.26 64.04 1.61 Allowed 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.78 1.232 . . . . 0.0 109.403 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.3 m 62.95 147.42 0.09 OUTLIER Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 127.034 2.134 . . . . 0.0 111.536 -168.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.81 -61.17 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.887 2.391 . . . . 0.0 110.74 169.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.69 164.03 37.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 128.07 2.548 . . . . 0.0 108.059 176.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 7.6 t -81.12 164.46 22.38 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.107 0.48 . . . . 0.0 109.826 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 126.57 168.55 12.61 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 126.516 2.007 . . . . 0.0 110.635 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.67 177.3 5.65 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.868 2.378 . . . . 0.0 109.81 170.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 61.4 m -121.88 143.84 49.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 153.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 m 56.83 175.01 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.307 1.043 . . . . 0.0 111.979 -164.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 N-CA-C 110.281 -1.127 . . . . 0.0 110.281 -163.497 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.534 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.88 85.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.884 1.673 . . . . 0.0 110.03 -168.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t 69.91 171.13 0.31 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.323 1.849 . . . . 0.0 111.695 -173.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 62.1 173.94 1.79 Allowed Glycine 0 CA--C 1.531 1.031 0 C-N-CA 127.187 2.327 . . . . 0.0 115.515 173.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.76 142.91 15.53 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.86 1.264 . . . . 0.0 108.308 174.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 t -150.02 140.57 22.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.038 1.335 . . . . 0.0 108.059 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.76 -177.32 35.62 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.962 173.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -67.67 -71.37 0.21 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.009 0.923 . . . . 0.0 108.973 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.8 -48.74 69.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.063 0.945 . . . . 0.0 112.968 -169.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -68.76 -27.55 65.99 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.557 -0.714 . . . . 0.0 111.181 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -82.13 -31.49 30.58 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 117.736 -1.126 . . . . 0.0 110.074 172.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.58 86.61 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 120.268 1.394 . . . . 0.0 110.724 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.73 92.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.078 0.551 . . . . 0.0 111.687 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -77.62 -29.31 51.77 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.575 -0.703 . . . . 0.0 111.249 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.71 -43.67 98.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 117.692 -1.147 . . . . 0.0 108.094 167.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.35 -49.5 72.09 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 110.039 174.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.8 mt -54.96 -53.93 49.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.013 0.525 . . . . 0.0 110.618 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.9 t -61.35 -47.42 93.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 118.92 0.782 . . . . 0.0 111.201 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -52.38 -58.35 6.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.119 1.767 . . . . 0.0 109.103 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.67 -38.36 80.34 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.93 0.892 . . . . 0.0 110.524 -175.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -61.75 -47.81 83.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.861 1.209 . . . . 0.0 110.496 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.04 -36.95 60.44 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 124.782 1.182 . . . . 0.0 111.091 -175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.43 -47.59 85.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.372 167.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -54.37 -50.46 67.44 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 119.628 1.104 . . . . 0.0 111.496 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 51.8 t -53.71 -45.85 61.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.641 1.109 . . . . 0.0 110.805 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -62.5 -49.86 73.69 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 121.47 -0.769 . . . . 0.0 110.336 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.0 -39.24 91.63 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-O 119.0 -0.889 . . . . 0.0 111.13 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 46.2 mt -69.53 -44.12 71.63 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.789 1.294 . . . . 0.0 109.418 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.41 -43.99 88.85 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 175.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -61.02 -43.16 99.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.562 0.745 . . . . 0.0 110.215 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -7.37 47.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.663 1.185 . . . . 0.0 111.736 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.6 mtpt 54.56 38.83 30.52 Favored 'General case' 0 C--O 1.23 0.066 0 C-N-CA 126.937 2.095 . . . . 0.0 111.587 -171.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.65 165.73 4.82 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.088 0.471 . . . . 0.0 110.402 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 m -62.0 137.12 58.21 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 124.721 1.209 . . . . 0.0 111.571 -173.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.11 -39.67 75.54 Favored 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 123.933 0.893 . . . . 0.0 111.145 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -67.58 -27.17 66.71 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.502 1.121 . . . . 0.0 111.539 -175.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.7 tp -77.95 -49.3 14.4 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.613 -0.68 . . . . 0.0 109.198 172.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.8 mt -50.83 -54.7 9.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.274 0 C-N-CA 123.856 0.863 . . . . 0.0 111.344 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 119.827 1.194 . . . . 0.0 111.836 -172.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -70.58 -41.04 72.91 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.302 175.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.87 -29.18 65.21 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.401 0.68 . . . . 0.0 110.512 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.0 t -68.08 -46.88 80.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.29 0 C-N-CA 125.065 1.346 . . . . 0.0 108.854 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.46 -47.13 76.56 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.729 1.15 . . . . 0.0 109.84 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -60.43 -47.59 85.44 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 123.908 0.883 . . . . 0.0 111.942 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.442 HD11 ' HE3' ' A' ' 49' ' ' LYS . 56.9 tp -55.75 -47.02 77.68 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.726 1.211 . . . . 0.0 110.23 177.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.48 -51.28 69.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.572 1.549 . . . . 0.0 110.633 -177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -71.05 -34.94 71.71 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 118.672 -0.68 . . . . 0.0 112.167 -178.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.9 mt -56.42 -54.3 47.31 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.229 0.922 . . . . 0.0 109.535 169.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HE3' HD11 ' A' ' 45' ' ' LEU . 80.9 mttt -58.5 -22.48 55.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 117.962 -1.018 . . . . 0.0 113.66 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.49 -38.94 65.21 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.649 1.113 . . . . 0.0 111.106 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -63.01 -34.37 77.42 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.699 0.681 . . . . 0.0 111.408 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.02 -6.62 4.12 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -90.78 103.41 3.04 Favored Glycine 0 CA--C 1.53 1.029 0 N-CA-C 107.392 -2.283 . . . . 0.0 107.392 158.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.7 55.14 2.64 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 124.086 3.191 . . . . 0.0 110.35 169.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -77.19 169.46 18.29 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.761 1.224 . . . . 0.0 109.142 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -66.42 115.62 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.1 m -68.18 168.12 12.85 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.921 0.867 . . . . 0.0 110.424 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -52.4 138.08 27.94 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 155.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.2 tm0? -114.29 -31.66 6.21 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 -171.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -146.83 162.44 38.61 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -61.55 104.72 0.45 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 119.054 0.843 . . . . 0.0 108.92 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 68.3 t -139.69 65.43 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 27.3 tp -91.54 168.91 11.18 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -131.12 148.47 52.73 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 68.05 152.6 0.13 Allowed Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 124.685 1.241 . . . . 0.0 109.91 -165.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -82.28 163.01 17.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 0.0 110.958 175.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -133.99 164.69 26.74 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 121.39 -0.818 . . . . 0.0 108.872 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.9 t -74.39 99.44 3.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.26 85.18 0.38 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.168 2.318 . . . . 0.0 110.289 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.63 92.76 0.94 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 123.282 2.654 . . . . 0.0 109.872 176.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.2 t -152.91 118.22 5.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -135.45 -39.73 0.73 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.426 1.49 . . . . 0.0 112.315 -172.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.426 0 C-N-CA 126.696 2.094 . . . . 0.0 108.261 -173.138 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.744 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -69.29 155.31 40.63 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.079 0.951 . . . . 0.0 112.577 -173.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.0 p -143.91 45.08 1.47 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.748 2.019 . . . . 0.0 109.165 -172.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 119.48 170.43 14.52 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -162.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 m -87.61 136.02 33.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 164.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 p -151.2 90.99 1.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 172.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 147.81 99.27 0.22 Allowed Glycine 0 CA--C 1.508 -0.37 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -173.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -54.52 -40.26 68.43 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.214 1.006 . . . . 0.0 112.158 -176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.04 -52.82 63.33 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.433 0.561 . . . . 0.0 110.471 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -62.24 -43.08 99.63 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -62.6 -40.41 96.85 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.466 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.42 -34.96 69.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 120.624 1.557 . . . . 0.0 113.218 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.31 -33.6 32.47 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.683 0.674 . . . . 0.0 112.211 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.48 -42.04 71.91 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 118.739 0.7 . . . . 0.0 109.396 174.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -59.91 -34.65 73.5 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.36 1.464 . . . . 0.0 109.824 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.51 -47.83 84.45 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 119.322 0.965 . . . . 0.0 110.954 174.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.7 mt -58.29 -41.2 83.88 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -63.57 -49.01 84.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 C-N-CA 123.165 0.586 . . . . 0.0 111.385 177.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -56.43 -57.65 11.38 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.365 1.866 . . . . 0.0 109.265 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.24 -41.6 98.57 Favored 'General case' 0 CA--C 1.513 -0.472 0 C-N-CA 125.392 1.477 . . . . 0.0 110.968 -176.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 -66.34 -43.53 85.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.454 1.025 . . . . 0.0 110.716 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.25 -48.01 87.85 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.1 -45.14 75.43 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.078 0.951 . . . . 0.0 110.673 173.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -61.81 -50.94 70.29 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.507 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.2 t -53.83 -47.43 63.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 120.034 1.288 . . . . 0.0 110.08 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -44.02 83.14 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.735 0.814 . . . . 0.0 110.655 177.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.33 -42.43 94.02 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.617 1.103 . . . . 0.0 112.681 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.7 mt -66.84 -40.3 87.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.701 1.751 . . . . 0.0 109.907 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -58.06 -43.27 86.85 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.885 0.474 . . . . 0.0 110.301 172.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -62.78 -46.39 88.21 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.26 0.936 . . . . 0.0 110.28 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -67.52 -6.7 20.99 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 126.613 1.965 . . . . 0.0 112.508 -174.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 46.33 53.8 9.19 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.034 1.334 . . . . 0.0 109.496 -164.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.2 166.35 1.14 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-O 121.273 0.559 . . . . 0.0 110.32 162.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.93 136.83 56.0 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.608 1.163 . . . . 0.0 108.998 172.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.49 -38.27 80.45 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.584 0.353 . . . . 0.0 111.631 -171.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -72.8 -28.85 62.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.572 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.0 tp -60.82 -51.0 71.19 Favored 'General case' 0 C--N 1.343 0.288 0 N-CA-C 107.923 -1.139 . . . . 0.0 107.923 175.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mt -55.74 -50.54 67.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.148 0.979 . . . . 0.0 108.781 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -58.27 -39.94 80.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.868 1.267 . . . . 0.0 112.794 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.63 -48.48 66.61 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.207 0.603 . . . . 0.0 109.85 174.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.66 -25.39 67.33 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.271 -0.893 . . . . 0.0 110.066 -176.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.1 -47.66 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.853 2.061 . . . . 0.0 110.463 170.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.14 -50.67 68.68 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 119.06 0.845 . . . . 0.0 108.814 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -60.84 -38.62 86.12 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.5 tp -60.52 -53.77 53.51 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 125.097 1.359 . . . . 0.0 109.91 173.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.14 -45.93 91.27 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.123 1.369 . . . . 0.0 111.244 -177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mtpt -55.52 -52.92 62.08 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.028 1.331 . . . . 0.0 110.268 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.37 -47.33 86.32 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-O 119.008 -0.52 . . . . 0.0 111.426 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -55.44 -38.83 69.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.236 0.925 . . . . 0.0 110.754 177.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.36 -37.59 87.52 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.289 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -65.22 -30.08 70.93 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.488 -1.244 . . . . 0.0 113.484 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -60.1 -75.66 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 168.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.06 74.39 1.28 Allowed Glycine 0 CA--C 1.53 1.022 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -164.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.51 -46.53 3.82 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.229 1.953 . . . . 0.0 111.255 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -170.31 94.51 0.23 Allowed 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 126.502 1.921 . . . . 0.0 107.293 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.98 136.62 10.16 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.8 m -73.84 104.69 4.81 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -136.04 -63.19 0.66 Allowed 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 124.261 1.024 . . . . 0.0 110.228 -176.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 65.11 -66.77 0.13 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.276 1.83 . . . . 0.0 112.123 -173.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.0 mttm 59.0 17.88 5.8 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.723 2.009 . . . . 0.0 112.358 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -117.38 67.78 0.74 Allowed 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.408 1.483 . . . . 0.0 107.86 -167.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.6 88.36 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 172.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' H ' HD23 ' A' ' 63' ' ' LEU . 2.0 pt? -58.29 157.46 8.48 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 168.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -129.71 -6.59 4.59 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.3 t -159.23 148.57 14.57 Favored Pre-proline 0 C--O 1.243 0.717 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.31 94.02 0.91 Allowed 'Trans proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.333 2.688 . . . . 0.0 108.0 176.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.03 136.54 57.16 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.44 149.62 22.6 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 167.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.88 177.49 46.71 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.25 95.02 0.49 Allowed 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.376 2.717 . . . . 0.0 110.481 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.4 t -66.01 -176.22 0.38 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.734 0.778 . . . . 0.0 109.078 164.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 p -125.96 130.12 50.62 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.041 1.337 . . . . 0.0 107.886 169.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.764 0 C-N-CA 124.554 1.073 . . . . 0.0 110.894 -177.084 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.71 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -75.33 173.99 10.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.9 1.68 . . . . 0.0 110.452 170.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.2 p -106.7 -8.2 16.97 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.747 -1.22 . . . . 0.0 112.03 166.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.96 -96.68 0.97 Allowed Glycine 0 C--N 1.337 0.591 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 173.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 m -158.51 166.77 31.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 126.595 1.958 . . . . 0.0 107.729 160.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.8 m -138.66 155.66 48.09 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.789 1.236 . . . . 0.0 107.691 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 173.75 61.24 0.05 OUTLIER Glycine 0 C--O 1.225 -0.413 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 177.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.06 -23.91 65.92 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.415 0.607 . . . . 0.0 112.609 -171.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.87 66.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.764 0.711 . . . . 0.0 110.737 171.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -64.42 -47.87 77.49 Favored 'General case' 0 C--O 1.225 -0.187 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -56.01 -37.0 68.56 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 117.397 -1.287 . . . . 0.0 110.356 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.1 -35.31 76.31 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.971 1.714 . . . . 0.0 112.365 177.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.81 -42.12 86.41 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.557 1.071 . . . . 0.0 110.573 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB3' HD21 ' A' ' 52' ' ' LEU . 59.2 mt -66.6 -39.85 88.58 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.357 1.063 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -65.83 -26.96 67.9 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.461 1.504 . . . . 0.0 112.288 172.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -69.25 -47.68 63.98 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.563 1.145 . . . . 0.0 109.216 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.31 -21.42 65.24 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.868 0.867 . . . . 0.0 111.79 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.4 t -95.7 -32.01 4.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 119.363 0.983 . . . . 0.0 111.505 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -58.53 -67.86 0.32 Allowed 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.25 -41.61 96.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.664 -1.16 . . . . 0.0 110.48 -166.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -59.74 -51.77 68.36 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.724 0.693 . . . . 0.0 109.591 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.1 -47.06 92.43 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 112.341 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.79 -37.81 80.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.44 1.496 . . . . 0.0 110.532 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -73.13 -39.52 65.66 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.143 -1.408 . . . . 0.0 110.463 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -57.74 -45.26 86.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 120.777 1.626 . . . . 0.0 109.121 174.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -53.16 -53.94 43.21 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 174.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.53 -49.95 55.21 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 124.726 1.155 . . . . 0.0 111.304 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.37 -38.36 84.63 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.611 1.705 . . . . 0.0 111.373 -173.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -58.16 -54.69 44.11 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -54.25 -45.65 72.41 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.029 1.732 . . . . 0.0 110.712 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -67.77 -6.84 23.1 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.734 2.013 . . . . 0.0 112.666 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt 47.51 49.4 16.03 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.396 1.478 . . . . 0.0 109.435 -170.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.57 168.5 4.66 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 165.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.0 m -53.37 136.94 36.55 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.934 1.294 . . . . 0.0 110.403 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -49.86 -45.83 50.87 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 125.279 1.431 . . . . 0.0 110.856 178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.99 -17.95 59.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -175.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 26.7 tp -68.02 -47.38 68.61 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 169.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.2 mt -60.32 -43.17 93.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.665 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -55.44 -46.89 76.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 120.517 1.508 . . . . 0.0 110.454 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.1 -50.12 73.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 C-N-CA 123.584 0.754 . . . . 0.0 108.997 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.78 -30.38 61.43 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.126 1.37 . . . . 0.0 111.684 -172.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.6 t -70.22 -44.88 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 125.652 1.581 . . . . 0.0 109.227 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.34 -47.22 86.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 118.703 0.683 . . . . 0.0 109.946 174.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.7 mtpt -59.32 -41.69 89.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.488 0.586 . . . . 0.0 111.471 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -61.05 -53.08 61.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.481 1.113 . . . . 0.0 110.512 177.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt -56.35 -52.67 63.71 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 124.812 1.245 . . . . 0.0 110.466 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -57.83 -45.36 86.28 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.331 0.652 . . . . 0.0 110.587 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 mt -58.95 -47.43 85.13 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 119.005 0.821 . . . . 0.0 111.21 174.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -59.94 -29.22 68.25 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 120.296 1.407 . . . . 0.0 111.667 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.68 -30.1 62.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.018 0.826 . . . . 0.0 112.163 173.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -68.99 -42.97 75.78 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.183 0.901 . . . . 0.0 110.035 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 14' ' ' LEU . 3.5 mm? -65.9 -15.73 63.21 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.072 0.949 . . . . 0.0 112.357 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -105.62 -165.79 23.5 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.79 1.662 . . . . 0.0 111.328 -170.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -69.08 131.48 22.3 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.354 2.036 . . . . 0.0 107.101 169.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.58 133.71 54.22 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 122.79 0.436 . . . . 0.0 109.895 -169.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -92.23 163.39 13.93 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.206 1.002 . . . . 0.0 110.561 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.72 144.91 46.16 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.105 0.562 . . . . 0.0 109.527 175.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -150.51 -50.44 0.13 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.347 1.459 . . . . 0.0 110.361 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -159.81 130.89 5.87 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.351 0.661 . . . . 0.0 109.787 -171.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.93 94.44 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 128.477 2.711 . . . . 0.0 112.623 176.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -52.52 148.83 6.45 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 -175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 3.2 m -123.54 93.2 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 124.635 1.174 . . . . 0.0 108.036 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -140.62 104.72 4.79 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.173 1.389 . . . . 0.0 109.917 -175.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 73.6 mttt 52.12 -155.08 0.17 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.131 1.772 . . . . 0.0 109.563 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.6 p -117.65 150.34 46.66 Favored Pre-proline 0 C--O 1.24 0.58 0 CA-C-N 119.454 1.025 . . . . 0.0 111.981 -166.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -59.02 -51.36 6.92 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 123.026 2.484 . . . . 0.0 109.989 165.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? 40.69 54.06 3.09 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 126.235 1.814 . . . . 0.0 109.487 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 40.6 p -144.27 119.32 10.04 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.368 0.667 . . . . 0.0 110.251 -167.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 102.74 -154.65 18.33 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.35 151.92 64.56 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 121.87 1.714 . . . . 0.0 111.633 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 27.4 m -137.55 131.1 31.22 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.834 1.654 . . . . 0.0 107.771 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 51.3 p -87.37 175.04 8.18 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.592 0.757 . . . . 0.0 110.389 173.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.98 0 N-CA-C 105.698 -2.961 . . . . 0.0 105.698 179.497 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 N-CA-C 109.267 -1.533 . . . . 0.0 109.267 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.0 m -153.05 -39.67 0.1 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.3 m -139.46 -28.25 0.77 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 119.025 0.83 . . . . 0.0 112.661 -174.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.79 146.76 38.95 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 173.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -79.98 65.51 5.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.063 . . . . 0.0 110.237 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.7 t -62.12 123.66 18.73 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 169.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 168.82 -95.3 0.11 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 108.676 -1.77 . . . . 0.0 108.676 -172.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.6 mtm -59.23 -45.69 90.46 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.182 0.991 . . . . 0.0 110.284 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.57 -7.8 3.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -90.55 -51.47 5.38 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 120.611 -1.305 . . . . 0.0 108.892 169.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -62.97 -42.02 99.71 Favored 'General case' 0 C--O 1.222 -0.392 0 O-C-N 121.692 -0.63 . . . . 0.0 109.679 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.71 71.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.247 1.419 . . . . 0.0 112.081 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.93 -43.98 64.38 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.708 0.685 . . . . 0.0 109.779 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -64.85 -37.74 88.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.371 0.668 . . . . 0.0 111.251 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -65.0 -39.06 92.89 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 126.713 2.005 . . . . 0.0 110.015 173.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.26 -51.16 67.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.358 1.063 . . . . 0.0 108.768 176.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -57.64 -45.3 85.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.646 -0.693 . . . . 0.0 110.012 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.79 -43.56 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 120.249 1.386 . . . . 0.0 110.213 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.483 ' HE2' ' CD2' ' A' ' 20' ' ' LEU . 6.9 ttpt -60.56 -51.82 67.8 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 124.048 0.939 . . . . 0.0 109.615 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.483 ' CD2' ' HE2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -61.49 -47.59 84.96 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 126.342 1.857 . . . . 0.0 111.438 177.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -61.06 -46.02 92.39 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.064 0.946 . . . . 0.0 109.436 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.17 -46.01 92.15 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 123.955 0.788 . . . . 0.0 111.354 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.29 -42.03 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.443 0.697 . . . . 0.0 109.903 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 -61.39 -52.82 63.0 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 117.914 -1.041 . . . . 0.0 109.749 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.35 -48.99 32.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 119.742 1.156 . . . . 0.0 111.24 -177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -60.66 -44.74 96.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.391 0.996 . . . . 0.0 110.069 177.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.99 -50.91 43.04 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 123.99 0.805 . . . . 0.0 111.125 173.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.7 -42.64 95.16 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 119.509 1.655 . . . . 0.0 111.007 -175.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -56.83 -50.6 71.9 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.905 0.882 . . . . 0.0 109.149 174.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -53.9 -45.72 71.21 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.067 0.947 . . . . 0.0 110.312 173.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -78.52 -7.32 57.36 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.91 1.284 . . . . 0.0 112.129 -167.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? 54.4 44.85 28.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.823 1.249 . . . . 0.0 109.373 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.57 172.91 3.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.85 166.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.7 m -56.09 137.37 51.47 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 122.086 -0.384 . . . . 0.0 110.58 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.25 -35.43 75.46 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 119.589 -0.243 . . . . 0.0 110.533 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.72 -26.71 68.82 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.883 1.273 . . . . 0.0 111.991 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.2 tp -77.91 -53.23 7.69 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 173.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.4 mt -53.95 -56.31 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.104 0 C-N-CA 124.993 1.317 . . . . 0.0 110.196 -175.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.46 -33.49 72.99 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 118.077 0.399 . . . . 0.0 111.413 -171.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.7 -38.17 64.93 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 118.528 0.604 . . . . 0.0 110.945 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -64.36 -31.62 72.9 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.931 0.787 . . . . 0.0 109.965 173.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 53.2 t -69.32 -50.43 52.01 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 123.612 0.765 . . . . 0.0 109.764 170.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.28 -35.88 65.54 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.783 1.174 . . . . 0.0 110.944 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.52 -53.65 32.58 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.44 1.096 . . . . 0.0 110.221 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 44.3 tp -49.58 -41.73 42.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.989 1.316 . . . . 0.0 111.077 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.7 mt -61.19 -65.94 0.61 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.613 1.565 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -65.55 -27.25 68.31 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -176.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.5 mt -59.11 -48.41 81.7 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 118.847 0.749 . . . . 0.0 110.03 170.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -63.82 -25.13 68.03 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.094 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.58 89.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.575 1.08 . . . . 0.0 110.182 173.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -59.52 -40.09 86.01 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.637 0.775 . . . . 0.0 111.684 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -68.96 -10.52 57.82 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 125.363 1.465 . . . . 0.0 114.238 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.35 -133.57 2.99 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -170.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -73.51 82.32 1.68 Allowed 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.228 2.619 . . . . 0.0 109.278 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.71 146.73 48.33 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.748 1.219 . . . . 0.0 109.772 174.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -134.5 80.26 1.84 Allowed 'General case' 0 C--O 1.238 0.472 0 C-N-CA 126.36 1.864 . . . . 0.0 106.83 178.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.3 m -74.13 67.34 1.32 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.345 1.458 . . . . 0.0 111.077 -176.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.59 -22.32 66.13 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.884 -1.135 . . . . 0.0 113.454 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -163.76 158.27 19.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 119.357 0.98 . . . . 0.0 108.802 169.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.19 -178.99 0.22 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.929 2.092 . . . . 0.0 112.477 176.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -124.48 -2.09 8.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.27 2.228 . . . . 0.0 111.807 -174.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.9 t 44.63 68.62 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 125.964 1.705 . . . . 0.0 111.404 174.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.416 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.7 pt? -120.34 172.76 7.58 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.269 1.428 . . . . 0.0 111.878 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.09 -167.9 1.75 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.197 1.399 . . . . 0.0 109.642 -175.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.3 m -141.5 135.31 14.75 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 125.995 1.718 . . . . 0.0 106.715 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.76 130.6 15.98 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 122.737 2.292 . . . . 0.0 107.908 170.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 tttm -152.11 106.46 3.18 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 121.504 -0.747 . . . . 0.0 109.506 -173.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 42.96 74.07 0.12 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.846 2.459 . . . . 0.0 111.569 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -82.32 109.56 3.08 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.038 -1.423 . . . . 0.0 110.29 174.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.55 112.03 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 C-N-CA 122.56 2.173 . . . . 0.0 108.365 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.2 t -75.34 99.07 4.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 171.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.4 m -76.46 -40.78 49.48 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.412 -0.805 . . . . 0.0 111.506 -178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.983 0 N-CA-C 107.377 -2.289 . . . . 0.0 107.377 169.534 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.621 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -56.54 162.89 1.99 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 m -64.35 160.62 18.54 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.87 0.468 . . . . 0.0 111.472 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.9 179.92 40.29 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.312 1.911 . . . . 0.0 108.592 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -137.25 167.41 21.63 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.509 1.523 . . . . 0.0 108.335 172.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.1 t -145.26 65.25 1.25 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.436 0.562 . . . . 0.0 110.426 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -155.67 166.41 32.83 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 168.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -66.8 -52.82 39.4 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 117.805 0.803 . . . . 0.0 111.009 -174.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.13 -33.31 73.18 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -68.48 -48.59 64.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.751 1.22 . . . . 0.0 109.691 175.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -64.21 -46.93 81.7 Favored 'General case' 0 C--N 1.338 0.07 0 C-N-CA 123.616 0.766 . . . . 0.0 110.341 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -46.97 84.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.423 1.089 . . . . 0.0 110.927 176.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.71 -29.94 69.65 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.586 0.354 . . . . 0.0 111.844 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.14 -38.02 32.33 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 118.283 0.492 . . . . 0.0 110.056 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.23 -32.4 71.09 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.643 1.177 . . . . 0.0 111.076 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.29 -42.28 73.42 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 119.536 1.062 . . . . 0.0 112.393 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.9 mt -67.93 -41.74 82.11 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.602 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.03 -45.39 95.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 119.123 0.874 . . . . 0.0 110.172 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -59.48 -57.24 13.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 127.347 2.259 . . . . 0.0 110.038 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -46.44 83.26 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.935 1.694 . . . . 0.0 110.77 -178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -55.92 -45.66 78.67 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 119.496 1.044 . . . . 0.0 109.241 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.71 -53.02 48.81 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 124.388 0.994 . . . . 0.0 112.134 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -58.6 -47.1 85.46 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.941 0.896 . . . . 0.0 110.607 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.77 -44.47 81.31 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 117.829 -1.081 . . . . 0.0 110.43 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.573 ' HA ' HD12 ' A' ' 28' ' ' LEU . 4.9 t -50.29 -49.1 24.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 120.307 1.412 . . . . 0.0 110.869 172.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -58.17 -36.88 73.68 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.334 0.516 . . . . 0.0 111.004 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.4 -29.92 51.4 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.268 0.937 . . . . 0.0 114.18 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 25' ' ' VAL . 10.3 mt -65.07 -33.32 75.75 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 120.51 2.155 . . . . 0.0 109.893 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -69.81 -25.21 63.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.746 1.218 . . . . 0.0 111.59 174.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -77.38 -47.35 20.07 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.096 -1.003 . . . . 0.0 108.469 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -4.17 13.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.542 1.537 . . . . 0.0 111.995 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.9 pttt 39.13 59.2 1.72 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 127.525 2.33 . . . . 0.0 110.356 -169.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -69.76 176.19 3.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.72 169.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.6 m -52.79 136.21 34.19 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 124.721 1.208 . . . . 0.0 111.314 176.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.35 92.54 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.598 0.759 . . . . 0.0 111.06 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -69.56 -38.24 77.34 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 122.885 0.474 . . . . 0.0 110.557 178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.24 -39.49 94.07 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.42 -47.33 92.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 124.848 1.259 . . . . 0.0 109.696 174.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -61.18 -42.37 98.46 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 119.44 1.018 . . . . 0.0 111.171 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.0 -47.93 82.59 Favored 'General case' 0 CA--C 1.521 -0.17 0 C-N-CA 125.626 1.57 . . . . 0.0 109.98 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -74.44 -30.16 61.78 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 123.521 0.729 . . . . 0.0 110.206 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 70.2 t -70.02 -43.34 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 124.106 0.963 . . . . 0.0 109.558 168.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.31 88.56 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 119.731 1.15 . . . . 0.0 110.537 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 44.5 mttt -61.55 -52.89 62.59 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.772 1.229 . . . . 0.0 110.573 169.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -54.94 -40.97 70.49 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 118.858 0.754 . . . . 0.0 110.988 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.6 -64.83 0.81 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 125.209 1.404 . . . . 0.0 110.572 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 18.8 pttt -62.41 -33.61 75.12 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.272 -175.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.02 -58.17 9.02 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 119.351 0.978 . . . . 0.0 109.883 171.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.14 -37.02 68.92 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.637 0.653 . . . . 0.0 111.614 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.06 -21.18 65.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.488 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -82.63 -37.31 25.12 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.106 1.321 . . . . 0.0 111.773 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.89 -55.83 30.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.731 0.696 . . . . 0.0 109.939 172.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.22 0.18 Allowed Glycine 0 CA--C 1.531 1.05 0 N-CA-C 108.839 -1.705 . . . . 0.0 108.839 -166.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -59.97 3.72 0.21 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.91 3.74 . . . . 0.0 115.151 173.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -161.46 -176.29 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.0 2.12 . . . . 0.0 107.835 -167.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -150.56 177.61 9.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 127.912 2.485 . . . . 0.0 107.838 -160.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 66.8 m 28.58 55.48 0.1 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.612 2.365 . . . . 0.0 116.087 172.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -89.13 147.9 23.96 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 163.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -70.08 168.36 15.7 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.642 0.777 . . . . 0.0 109.374 160.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.98 166.49 11.35 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 122.264 1.03 . . . . 0.0 111.83 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -154.22 175.83 13.01 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.969 1.708 . . . . 0.0 107.484 173.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m -83.65 136.53 22.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 158.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.6 pp -154.22 163.14 40.59 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -133.32 160.83 36.17 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 t -158.73 149.38 15.91 Favored Pre-proline 0 C--O 1.238 0.469 0 C-N-CA 124.826 1.25 . . . . 0.0 107.772 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -76.82 152.97 33.0 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.867 1.711 . . . . 0.0 110.903 -178.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.92 176.34 9.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.653 1.981 . . . . 0.0 108.248 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 69.9 m 60.48 -153.93 0.37 Allowed 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.881 1.272 . . . . 0.0 110.14 -173.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.04 174.36 46.71 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 107.877 -2.089 . . . . 0.0 107.877 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -67.37 104.33 0.89 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.194 2.596 . . . . 0.0 108.974 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 75.2 m 56.46 -171.41 0.08 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.145 0.978 . . . . 0.0 111.681 -172.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.9 t -152.64 132.46 13.25 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -179.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 N-CA-C 106.314 -2.714 . . . . 0.0 106.314 -164.161 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 p -63.38 163.69 10.31 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.104 0.961 . . . . 0.0 111.838 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.8 t -139.06 160.14 40.49 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.479 -1.674 . . . . 0.0 106.479 166.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.75 -173.26 22.41 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.567 1.079 . . . . 0.0 111.84 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 m -141.74 128.78 20.79 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.97 26.81 0.06 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.108 1.763 . . . . 0.0 113.392 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.69 129.76 9.15 Favored Glycine 0 C--N 1.333 0.364 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.64 -38.76 88.87 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.317 1.059 . . . . 0.0 109.771 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.83 94.32 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.389 1.875 . . . . 0.0 112.02 171.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -63.54 -42.4 98.41 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 121.301 -0.874 . . . . 0.0 110.624 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -64.14 -44.06 93.34 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.336 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -39.08 73.96 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 119.481 1.037 . . . . 0.0 111.695 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.38 -40.21 95.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.768 0.827 . . . . 0.0 111.523 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.02 -33.51 59.65 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.759 0.708 . . . . 0.0 111.376 178.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.59 -36.56 84.2 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 125.175 1.39 . . . . 0.0 109.065 171.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -57.88 -49.37 76.93 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.409 1.084 . . . . 0.0 109.845 173.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.2 mt -59.69 -45.14 93.01 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.0 t -60.92 -47.9 91.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.077 0.853 . . . . 0.0 110.993 175.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.58 -54.08 51.14 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 125.543 1.537 . . . . 0.0 110.846 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -47.25 81.31 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.19 1.396 . . . . 0.0 110.251 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -64.11 -35.85 82.11 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.365 0.529 . . . . 0.0 110.854 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.74 -51.94 55.5 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 124.688 1.137 . . . . 0.0 110.678 170.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.78 -50.7 60.21 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 124.906 1.282 . . . . 0.0 109.63 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -69.2 -43.4 74.24 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.919 1.287 . . . . 0.0 111.46 -175.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.2 t -57.08 -51.79 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-N 120.509 1.504 . . . . 0.0 110.236 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -59.46 -32.94 70.7 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.762 -0.586 . . . . 0.0 110.833 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.89 -50.41 53.04 Favored Glycine 0 C--O 1.218 -0.87 0 C-N-CA 124.682 1.134 . . . . 0.0 112.426 171.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.48 -39.77 80.9 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 120.409 2.104 . . . . 0.0 111.075 -172.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -66.97 -31.43 72.0 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.955 0.902 . . . . 0.0 112.076 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -75.98 -43.99 41.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.682 1.593 . . . . 0.0 109.898 173.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -8.1 54.28 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.559 1.544 . . . . 0.0 110.774 -174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt 53.75 51.31 15.2 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.946 1.698 . . . . 0.0 109.447 -177.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.96 -178.96 2.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.903 0.881 . . . . 0.0 110.164 170.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.9 m -55.62 128.12 33.12 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.165 0.986 . . . . 0.0 110.108 176.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.57 73.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.339 1.055 . . . . 0.0 112.828 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.8 -44.68 61.21 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 123.692 0.797 . . . . 0.0 110.117 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 29.9 tp -54.25 -46.83 72.69 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.863 0.865 . . . . 0.0 109.643 173.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 mt -51.49 -50.78 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.174 0.99 . . . . 0.0 110.264 176.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.35 -39.08 78.32 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.73 0.696 . . . . 0.0 111.629 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.53 -47.98 81.53 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.735 0.814 . . . . 0.0 110.327 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.12 -37.73 84.38 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.875 0.87 . . . . 0.0 109.689 -177.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.6 t -60.77 -49.36 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.066 0.946 . . . . 0.0 110.125 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.76 -42.11 88.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.344 0.657 . . . . 0.0 109.949 -177.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -74.58 -37.07 63.02 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.241 1.416 . . . . 0.0 111.691 -178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 tp -57.79 -47.96 81.07 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.839 1.256 . . . . 0.0 110.364 167.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.5 mt -59.08 -45.22 91.36 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.654 0.781 . . . . 0.0 110.663 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -63.6 -42.12 98.27 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.955 -0.545 . . . . 0.0 110.607 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.9 mt -54.95 -53.66 52.74 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 119.005 0.82 . . . . 0.0 109.912 171.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -57.91 -35.35 70.94 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 118.722 -0.656 . . . . 0.0 112.001 -177.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.86 -35.85 79.51 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.52 0.6 . . . . 0.0 110.679 176.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -70.23 -40.28 74.59 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 118.868 0.758 . . . . 0.0 111.972 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.78 -35.86 81.23 Favored 'General case' 0 C--O 1.226 -0.152 0 CA-C-O 118.233 -0.889 . . . . 0.0 112.953 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.61 103.48 2.32 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.663 1.601 . . . . 0.0 109.542 -169.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -70.66 155.46 62.94 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.236 1.958 . . . . 0.0 110.43 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 53.89 59.23 4.41 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 125.658 1.583 . . . . 0.0 110.925 168.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.92 117.63 11.74 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -79.09 85.6 4.98 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -139.62 156.92 46.57 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -70.5 154.91 41.38 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -76.72 98.04 4.65 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.593 0.757 . . . . 0.0 111.253 -175.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -76.47 -10.37 59.35 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.821 -1.174 . . . . 0.0 111.62 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 96.7 t 51.2 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.23 1.812 . . . . 0.0 110.988 168.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 tt -144.68 94.64 2.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.078 -1.014 . . . . 0.0 108.855 -174.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.36 114.83 4.54 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 162.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.2 m -61.58 153.47 70.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 165.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.65 -166.96 0.12 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.78 2.987 . . . . 0.0 112.12 165.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -131.53 -27.44 1.94 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.947 1.699 . . . . 0.0 110.688 164.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.8 m -147.69 167.11 25.47 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 119.457 1.026 . . . . 0.0 109.663 171.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.39 -175.81 43.33 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.157 1.361 . . . . 0.0 110.792 167.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -69.63 -71.02 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.221 3.28 . . . . 0.0 111.061 174.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.2 t -147.16 116.48 6.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 104.791 -2.299 . . . . 0.0 104.791 167.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.5 m -81.29 36.55 0.42 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.784 1.234 . . . . 0.0 112.009 -175.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.382 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.462 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.428 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.8 m -63.54 174.51 1.3 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.41 1.484 . . . . 0.0 113.056 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.6 t -126.75 -68.74 0.79 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.39 1.876 . . . . 0.0 106.934 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.64 -102.01 0.62 Allowed Glycine 0 CA--C 1.525 0.664 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 165.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.9 m 36.78 59.8 1.0 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.842 2.057 . . . . 0.0 112.424 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.5 t -71.69 165.22 24.45 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 122.27 1.033 . . . . 0.0 110.992 -176.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.75 156.83 12.5 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 127.502 2.477 . . . . 0.0 107.42 173.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.4 ttt -68.57 -41.46 79.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 118.237 1.019 . . . . 0.0 110.386 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.12 96.2 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 123.529 0.732 . . . . 0.0 110.288 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.85 -48.3 80.19 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.543 1.137 . . . . 0.0 109.841 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -59.85 -55.03 39.28 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.8 -176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.81 82.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.634 0.652 . . . . 0.0 111.469 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.72 -39.93 90.43 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.993 0.517 . . . . 0.0 111.726 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.47 -35.42 58.44 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 118.3 0.5 . . . . 0.0 111.221 177.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.54 -33.49 72.74 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.017 0.927 . . . . 0.0 109.335 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -49.81 75.97 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.723 0.809 . . . . 0.0 109.587 173.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.43 -40.06 95.32 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 118.006 0.366 . . . . 0.0 110.595 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 72.5 t -66.45 -51.42 57.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 123.728 0.811 . . . . 0.0 110.129 177.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -53.21 -57.15 11.48 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.497 1.519 . . . . 0.0 108.096 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.5 -40.28 96.67 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.677 -173.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -61.04 -45.16 95.91 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.426 1.012 . . . . 0.0 110.374 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.11 -51.63 57.26 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.035 0.826 . . . . 0.0 111.933 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -51.9 67.41 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.507 1.523 . . . . 0.0 108.633 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -52.2 66.71 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.863 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.4 t -56.71 -41.67 75.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.995 1.27 . . . . 0.0 111.091 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -63.07 -27.11 69.17 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.434 1.015 . . . . 0.0 110.939 175.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.92 -43.62 10.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 124.379 0.99 . . . . 0.0 112.593 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.74 -39.91 71.8 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 119.774 1.787 . . . . 0.0 110.743 -176.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -60.4 -52.18 66.32 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.995 1.318 . . . . 0.0 110.844 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -56.81 -42.81 80.22 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.092 0.957 . . . . 0.0 110.361 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -73.41 -0.96 16.34 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.1 1.76 . . . . 0.0 111.849 -174.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.4 mmtt 47.64 37.16 6.32 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.951 1.301 . . . . 0.0 112.017 -173.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.31 162.5 4.61 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 170.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.5 m -48.27 133.66 15.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.583 1.153 . . . . 0.0 109.768 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.18 63.52 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.244 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.39 -45.67 92.11 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 117.83 -1.081 . . . . 0.0 111.571 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.4 -52.55 64.2 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.501 1.046 . . . . 0.0 109.461 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 mt -50.62 -49.06 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 126.298 1.839 . . . . 0.0 109.882 176.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -52.38 65.72 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 125.338 1.455 . . . . 0.0 111.686 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.22 -43.45 96.01 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 125.005 1.322 . . . . 0.0 108.993 -176.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.92 -28.95 61.78 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.662 1.185 . . . . 0.0 112.511 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.714 1.606 . . . . 0.0 109.62 170.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -58.01 -48.41 80.11 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 174.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -63.71 -37.71 88.37 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 121.299 -0.875 . . . . 0.0 112.519 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.48 -41.49 89.9 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.396 1.078 . . . . 0.0 111.016 172.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.54 -54.16 40.59 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.34 1.056 . . . . 0.0 110.582 174.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -54.0 -47.82 71.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 125.631 1.572 . . . . 0.0 110.942 -178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.51 -56.5 19.53 Favored 'General case' 0 N--CA 1.458 -0.074 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.955 172.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mttm -55.72 -33.64 64.4 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.371 -0.823 . . . . 0.0 112.831 -179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.41 -24.3 67.78 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.241 0.928 . . . . 0.0 112.723 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -76.78 -47.19 22.36 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.02 0.827 . . . . 0.0 110.509 172.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.99 -60.11 3.7 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.711 0.804 . . . . 0.0 108.98 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.49 141.17 3.98 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.16 -35.64 14.0 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 121.658 1.572 . . . . 0.0 111.295 178.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -98.6 70.95 1.96 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-O 122.108 0.956 . . . . 0.0 110.091 -162.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -155.66 46.7 0.49 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.318 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.37 -16.92 4.8 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -154.99 161.2 41.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.048 1.295 . . . . 0.0 109.497 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -136.87 160.94 37.39 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.045 0.938 . . . . 0.0 108.777 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -90.58 -26.91 19.45 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.874 0.87 . . . . 0.0 111.244 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -69.54 125.5 26.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 162.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 70.2 t -131.8 93.52 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.35 142.72 58.13 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -85.39 -69.82 0.63 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 165.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 p -57.47 156.33 16.69 Favored Pre-proline 0 CA--C 1.54 0.572 0 C-N-CA 124.276 1.031 . . . . 0.0 111.551 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.91 176.41 9.5 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.242 1.961 . . . . 0.0 109.743 -174.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -157.94 161.31 38.18 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.082 -1.011 . . . . 0.0 109.197 174.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 70.27 -0.81 2.69 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.082 2.153 . . . . 0.0 114.783 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -117.93 60.83 0.46 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-O 117.938 -1.479 . . . . 0.0 111.797 165.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -60.04 -47.53 14.94 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.807 3.005 . . . . 0.0 113.267 -172.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.1 m -162.76 135.86 5.81 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 126.604 1.961 . . . . 0.0 106.193 166.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 t -173.9 112.81 0.19 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 105.0 -2.222 . . . . 0.0 105.0 176.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 N-CA-C 104.165 -3.574 . . . . 0.0 104.165 176.241 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.799 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 t -138.32 156.81 47.28 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.202 1.001 . . . . 0.0 110.73 170.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.9 t -155.62 -13.2 0.11 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.006 2.122 . . . . 0.0 110.917 159.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.97 -77.7 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 CA-C-N 119.084 0.856 . . . . 0.0 111.814 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 m -61.52 143.86 55.24 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.68 . . . . 0.0 110.226 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 p -113.65 95.24 5.24 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.39 116.46 4.72 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 173.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -57.73 -28.25 63.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.773 1.287 . . . . 0.0 112.553 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -56.81 16.74 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.77 -30.85 71.56 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.983 0.913 . . . . 0.0 111.131 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -60.74 -53.21 60.18 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -44.21 83.12 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.16 0.436 . . . . 0.0 111.215 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.44 -30.7 70.51 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.814 0.734 . . . . 0.0 112.86 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.64 -40.08 50.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 109.623 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.22 -33.6 73.76 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.667 1.987 . . . . 0.0 111.545 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.74 -48.51 79.4 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.723 0.809 . . . . 0.0 108.892 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.06 -44.83 94.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 118.638 -0.696 . . . . 0.0 109.83 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.76 -53.48 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.547 0.739 . . . . 0.0 110.486 176.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -56.5 -59.53 4.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 124.934 1.294 . . . . 0.0 109.117 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -62.61 -36.89 84.19 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.09 0.868 . . . . 0.0 111.01 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -59.75 -51.1 71.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 119.169 0.895 . . . . 0.0 109.411 175.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.0 -44.91 95.22 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 118.844 0.747 . . . . 0.0 112.75 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.17 -28.84 69.95 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 117.966 0.883 . . . . 0.0 111.167 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -74.43 -40.85 61.7 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.871 170.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 50.1 t -59.55 -48.07 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 120.646 1.566 . . . . 0.0 109.055 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -59.56 -42.1 91.64 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.67 -0.644 . . . . 0.0 110.446 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.05 -47.77 89.15 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-O 118.931 -0.927 . . . . 0.0 111.966 172.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.95 -42.56 89.85 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.824 1.812 . . . . 0.0 110.961 -175.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -58.14 -41.93 84.78 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.521 -0.737 . . . . 0.0 111.148 172.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -66.2 -42.18 89.13 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 120.352 -1.467 . . . . 0.0 110.935 177.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -68.31 -0.89 5.29 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.642 2.377 . . . . 0.0 111.922 176.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 51.01 39.66 23.62 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.572 1.949 . . . . 0.0 110.663 -175.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.04 165.27 2.54 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.667 175.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -57.33 130.96 48.55 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.979 1.311 . . . . 0.0 109.604 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.72 -34.52 62.56 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.88 0.872 . . . . 0.0 111.846 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.66 -58.45 8.26 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 126.143 1.777 . . . . 0.0 110.422 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 36.0 tp -56.63 -40.02 74.66 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.67 1.188 . . . . 0.0 109.965 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.8 mt -64.63 -47.23 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 118.27 -0.871 . . . . 0.0 109.227 179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -68.72 -27.79 66.25 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 120.5 1.5 . . . . 0.0 112.15 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -61.08 -53.88 51.65 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-N 119.512 1.051 . . . . 0.0 109.775 167.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -70.33 -31.33 68.58 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 123.42 0.688 . . . . 0.0 111.645 -171.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.09 -45.74 82.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 126.278 1.831 . . . . 0.0 109.201 172.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.84 -45.83 91.19 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-N 119.424 1.011 . . . . 0.0 110.335 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -55.78 -54.28 46.41 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.53 0.732 . . . . 0.0 109.916 172.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 tp -54.78 -43.31 72.68 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.283 0.947 . . . . 0.0 110.999 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.7 mt -59.51 -64.43 0.95 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 125.115 1.366 . . . . 0.0 110.979 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.85 -32.24 72.56 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.987 -0.445 . . . . 0.0 112.025 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.1 mt -61.88 -51.57 67.65 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.398 1.079 . . . . 0.0 109.795 171.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -60.41 -25.54 66.01 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.22 1.008 . . . . 0.0 112.848 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.76 -40.39 94.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.154 0.888 . . . . 0.0 110.668 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -57.1 -43.46 82.25 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.739 1.216 . . . . 0.0 111.102 -178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.84 -10.16 26.16 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.965 1.306 . . . . 0.0 113.628 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.64 97.98 1.77 Allowed Glycine 0 CA--C 1.53 1.017 0 CA-C-N 120.277 1.399 . . . . 0.0 110.729 177.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -68.18 137.45 40.51 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.227 1.951 . . . . 0.0 109.757 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -65.79 156.2 33.88 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 122.876 0.471 . . . . 0.0 110.535 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -135.18 87.06 2.3 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.589 0.756 . . . . 0.0 109.182 -156.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.5 p -138.14 -83.98 0.3 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 124.038 0.935 . . . . 0.0 109.016 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -64.86 118.92 9.73 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 35.44 66.96 0.3 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 126.808 2.043 . . . . 0.0 111.964 -174.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -82.7 158.75 22.79 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.332 159.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -156.54 100.51 1.95 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 m -140.68 139.24 35.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.193 0.597 . . . . 0.0 110.65 -164.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.5 tp -122.17 -93.54 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 117.23 -1.366 . . . . 0.0 108.884 170.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -139.08 80.75 1.8 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 126.267 1.827 . . . . 0.0 108.128 -171.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.1 p -141.64 97.81 6.57 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.408 -168.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.97 -31.5 55.88 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.266 1.311 . . . . 0.0 111.239 168.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 tttt 42.77 47.13 4.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.604 1.961 . . . . 0.0 111.265 -172.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.0 t -143.88 158.08 43.93 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.397 1.879 . . . . 0.0 108.593 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -157.04 103.61 0.24 Allowed Glycine 0 CA--C 1.525 0.7 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.24 -56.61 0.07 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.152 1.901 . . . . 0.0 110.145 -174.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -156.15 -70.98 0.11 Allowed 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.2 m 66.46 15.08 10.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.861 1.264 . . . . 0.0 113.061 -176.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 105.912 -2.875 . . . . 0.0 105.912 162.938 . . . . . . . . 0 0 . 1 stop_ save_